Chlorine in PDB 2jkl: Drae Adhesin in Complex with Bromamphenicol
Protein crystallography data
The structure of Drae Adhesin in Complex with Bromamphenicol, PDB code: 2jkl
was solved by
D.M.Pettigrew,
P.Roversi,
S.G.Davies,
A.J.Russell,
S.M.Lea,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
25.00 /
1.90
|
Space group
|
P 3
|
Cell size a, b, c (Å), α, β, γ (°)
|
119.600,
119.600,
57.800,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
18.3 /
19.8
|
Other elements in 2jkl:
The structure of Drae Adhesin in Complex with Bromamphenicol also contains other interesting chemical elements:
Chlorine Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Chlorine atom in the Drae Adhesin in Complex with Bromamphenicol
(pdb code 2jkl). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 12 binding sites of Chlorine where determined in the
Drae Adhesin in Complex with Bromamphenicol, PDB code: 2jkl:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 1 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1144
b:35.7
occ:0.58
|
CL1
|
A:CLM1144
|
0.0
|
35.7
|
0.6
|
BR2
|
A:BRX1143
|
0.3
|
27.7
|
0.2
|
C1
|
A:BRX1143
|
1.9
|
29.6
|
0.2
|
C1
|
A:CLM1144
|
2.0
|
37.3
|
0.6
|
C2
|
A:CLM1144
|
2.9
|
38.2
|
0.6
|
C2
|
A:BRX1143
|
2.9
|
31.7
|
0.2
|
O2
|
A:CLM1144
|
2.9
|
38.1
|
0.6
|
BR1
|
A:BRX1143
|
3.0
|
29.8
|
0.2
|
O2
|
A:BRX1143
|
3.0
|
31.8
|
0.2
|
O
|
A:GLY42
|
3.2
|
19.4
|
1.0
|
CL2
|
A:CLM1144
|
3.2
|
36.5
|
0.6
|
C
|
A:GLY42
|
3.4
|
19.3
|
1.0
|
N
|
A:ILE114
|
3.4
|
9.9
|
1.0
|
O
|
A:ILE114
|
3.4
|
12.2
|
1.0
|
N
|
A:GLY42
|
3.5
|
16.0
|
1.0
|
CA
|
A:GLY113
|
3.7
|
10.5
|
1.0
|
CA
|
A:GLY42
|
3.8
|
15.9
|
1.0
|
N
|
A:PRO43
|
3.9
|
15.1
|
1.0
|
CE1
|
A:TYR115
|
3.9
|
15.6
|
1.0
|
CZ
|
A:TYR115
|
3.9
|
20.2
|
1.0
|
CB
|
A:PRO40
|
4.0
|
16.0
|
1.0
|
C
|
A:GLY113
|
4.0
|
12.9
|
1.0
|
N2
|
A:CLM1144
|
4.0
|
39.8
|
0.6
|
N2
|
A:BRX1143
|
4.1
|
33.6
|
0.2
|
C
|
A:ILE114
|
4.1
|
12.8
|
1.0
|
N
|
A:ILE41
|
4.1
|
13.2
|
1.0
|
OH
|
A:TYR115
|
4.2
|
19.7
|
1.0
|
CA
|
A:PRO40
|
4.3
|
13.9
|
1.0
|
CA
|
A:PRO43
|
4.3
|
14.3
|
1.0
|
CA
|
A:ILE114
|
4.3
|
9.5
|
1.0
|
CD1
|
A:TYR115
|
4.4
|
14.8
|
1.0
|
CE2
|
A:TYR115
|
4.4
|
14.9
|
1.0
|
C
|
A:PRO40
|
4.6
|
16.9
|
1.0
|
CD
|
A:PRO43
|
4.6
|
16.7
|
1.0
|
C
|
A:ILE41
|
4.6
|
19.0
|
1.0
|
CG
|
A:TYR115
|
4.8
|
13.2
|
1.0
|
CD2
|
A:TYR115
|
4.8
|
14.2
|
1.0
|
CB
|
A:PRO43
|
4.9
|
16.1
|
1.0
|
CA
|
A:ILE41
|
5.0
|
13.6
|
1.0
|
|
Chlorine binding site 2 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 2 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1144
b:36.5
occ:0.58
|
CL2
|
A:CLM1144
|
0.0
|
36.5
|
0.6
|
BR1
|
A:BRX1143
|
0.4
|
29.8
|
0.2
|
C1
|
A:CLM1144
|
2.0
|
37.3
|
0.6
|
C1
|
A:BRX1143
|
2.0
|
29.6
|
0.2
|
C2
|
A:BRX1143
|
2.8
|
31.7
|
0.2
|
C2
|
A:CLM1144
|
3.0
|
38.2
|
0.6
|
CL1
|
A:CLM1144
|
3.2
|
35.7
|
0.6
|
N2
|
A:CLM1144
|
3.3
|
39.8
|
0.6
|
O2
|
A:BRX1143
|
3.3
|
31.8
|
0.2
|
BR2
|
A:BRX1143
|
3.4
|
27.7
|
0.2
|
N2
|
A:BRX1143
|
3.6
|
33.6
|
0.2
|
CB
|
A:PRO43
|
3.6
|
16.1
|
1.0
|
CA
|
A:GLY113
|
3.8
|
10.5
|
1.0
|
O2
|
A:CLM1144
|
3.9
|
38.1
|
0.6
|
CG2
|
A:THR88
|
3.9
|
16.9
|
1.0
|
CA
|
A:PRO43
|
3.9
|
14.3
|
1.0
|
OH
|
A:TYR115
|
4.0
|
19.7
|
1.0
|
CG2
|
A:ILE111
|
4.0
|
14.4
|
1.0
|
C11
|
A:BRX1143
|
4.3
|
37.1
|
0.2
|
N
|
A:PRO43
|
4.3
|
15.1
|
1.0
|
C7
|
A:CLM1144
|
4.4
|
40.8
|
0.6
|
N
|
A:GLY113
|
4.5
|
11.3
|
1.0
|
C10
|
A:BRX1143
|
4.6
|
37.4
|
0.2
|
CG
|
A:PRO43
|
4.6
|
21.0
|
1.0
|
C8
|
A:CLM1144
|
4.6
|
40.5
|
0.6
|
C3
|
A:CLM1144
|
4.6
|
41.3
|
0.6
|
C6
|
A:BRX1143
|
4.6
|
36.8
|
0.2
|
C6
|
A:CLM1144
|
4.6
|
41.0
|
0.6
|
CD
|
A:PRO43
|
4.6
|
16.7
|
1.0
|
C3
|
A:BRX1143
|
4.7
|
35.2
|
0.2
|
CZ
|
A:TYR115
|
4.7
|
20.2
|
1.0
|
C5
|
A:BRX1143
|
4.8
|
36.2
|
0.2
|
C
|
A:GLY42
|
4.8
|
19.3
|
1.0
|
O
|
A:ILE112
|
4.8
|
15.6
|
1.0
|
O
|
A:GLY42
|
4.9
|
19.4
|
1.0
|
C5
|
A:CLM1144
|
4.9
|
41.6
|
0.6
|
C
|
A:ILE112
|
4.9
|
15.3
|
1.0
|
C9
|
A:CLM1144
|
5.0
|
40.0
|
0.6
|
|
Chlorine binding site 3 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 3 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1144
b:36.2
occ:0.46
|
CL1
|
B:CLM1144
|
0.0
|
36.2
|
0.5
|
BR2
|
B:BRX1143
|
0.1
|
25.7
|
0.3
|
C1
|
B:BRX1143
|
2.0
|
28.4
|
0.3
|
C1
|
B:CLM1144
|
2.0
|
37.2
|
0.5
|
C2
|
B:CLM1144
|
2.9
|
37.5
|
0.5
|
C2
|
B:BRX1143
|
2.9
|
30.3
|
0.3
|
O2
|
B:CLM1144
|
2.9
|
37.5
|
0.5
|
O2
|
B:BRX1143
|
3.0
|
30.5
|
0.3
|
CL2
|
B:CLM1144
|
3.2
|
38.4
|
0.5
|
BR1
|
B:BRX1143
|
3.3
|
29.7
|
0.3
|
O
|
B:GLY42
|
3.3
|
17.8
|
1.0
|
O
|
B:ILE114
|
3.3
|
11.8
|
1.0
|
C
|
B:GLY42
|
3.4
|
17.7
|
1.0
|
N
|
B:ILE114
|
3.4
|
7.7
|
1.0
|
N
|
B:GLY42
|
3.5
|
13.9
|
1.0
|
CA
|
B:GLY113
|
3.7
|
8.5
|
1.0
|
CA
|
B:GLY42
|
3.8
|
14.0
|
1.0
|
CB
|
B:PRO40
|
3.9
|
14.1
|
1.0
|
CE1
|
B:TYR115
|
3.9
|
13.6
|
1.0
|
N
|
B:PRO43
|
4.0
|
13.1
|
1.0
|
CZ
|
B:TYR115
|
4.0
|
18.1
|
1.0
|
N2
|
B:CLM1144
|
4.0
|
37.7
|
0.5
|
C
|
B:GLY113
|
4.0
|
10.8
|
1.0
|
N
|
B:ILE41
|
4.0
|
11.4
|
1.0
|
C
|
B:ILE114
|
4.1
|
11.7
|
1.0
|
N2
|
B:BRX1143
|
4.1
|
31.8
|
0.3
|
CA
|
B:PRO40
|
4.2
|
12.1
|
1.0
|
OH
|
B:TYR115
|
4.2
|
17.7
|
1.0
|
CD1
|
B:TYR115
|
4.3
|
13.1
|
1.0
|
CA
|
B:ILE114
|
4.4
|
7.4
|
1.0
|
CA
|
B:PRO43
|
4.4
|
12.1
|
1.0
|
CE2
|
B:TYR115
|
4.5
|
12.7
|
1.0
|
C
|
B:PRO40
|
4.5
|
15.5
|
1.0
|
C
|
B:ILE41
|
4.5
|
17.2
|
1.0
|
CD
|
B:PRO43
|
4.7
|
14.6
|
1.0
|
CG
|
B:TYR115
|
4.8
|
10.9
|
1.0
|
CD2
|
B:TYR115
|
4.8
|
11.6
|
1.0
|
CA
|
B:ILE41
|
4.9
|
11.5
|
1.0
|
CB
|
B:PRO43
|
5.0
|
14.1
|
1.0
|
|
Chlorine binding site 4 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 4 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1144
b:38.4
occ:0.46
|
CL2
|
B:CLM1144
|
0.0
|
38.4
|
0.5
|
BR1
|
B:BRX1143
|
0.4
|
29.7
|
0.3
|
C1
|
B:BRX1143
|
2.0
|
28.4
|
0.3
|
C1
|
B:CLM1144
|
2.0
|
37.2
|
0.5
|
C2
|
B:BRX1143
|
2.9
|
30.3
|
0.3
|
C2
|
B:CLM1144
|
2.9
|
37.5
|
0.5
|
CL1
|
B:CLM1144
|
3.2
|
36.2
|
0.5
|
BR2
|
B:BRX1143
|
3.2
|
25.7
|
0.3
|
N2
|
B:CLM1144
|
3.4
|
37.7
|
0.5
|
O2
|
B:BRX1143
|
3.4
|
30.5
|
0.3
|
CB
|
B:PRO43
|
3.4
|
14.1
|
1.0
|
N2
|
B:BRX1143
|
3.7
|
31.8
|
0.3
|
O2
|
B:CLM1144
|
3.7
|
37.5
|
0.5
|
CA
|
B:GLY113
|
3.7
|
8.5
|
1.0
|
CA
|
B:PRO43
|
3.8
|
12.1
|
1.0
|
CG2
|
B:ILE111
|
4.0
|
12.3
|
1.0
|
CG2
|
B:THR88
|
4.1
|
14.8
|
1.0
|
OH
|
B:TYR115
|
4.1
|
17.7
|
1.0
|
N
|
B:PRO43
|
4.2
|
13.1
|
1.0
|
C11
|
B:BRX1143
|
4.3
|
35.1
|
0.3
|
CG
|
B:PRO43
|
4.3
|
19.1
|
1.0
|
C7
|
B:CLM1144
|
4.4
|
36.8
|
0.5
|
N
|
B:GLY113
|
4.4
|
9.2
|
1.0
|
C10
|
B:BRX1143
|
4.5
|
35.5
|
0.3
|
CD
|
B:PRO43
|
4.5
|
14.6
|
1.0
|
C8
|
B:CLM1144
|
4.6
|
36.8
|
0.5
|
C6
|
B:BRX1143
|
4.6
|
34.9
|
0.3
|
C
|
B:GLY42
|
4.6
|
17.7
|
1.0
|
C6
|
B:CLM1144
|
4.6
|
37.1
|
0.5
|
O
|
B:ILE112
|
4.7
|
12.5
|
1.0
|
C3
|
B:CLM1144
|
4.7
|
38.1
|
0.5
|
O
|
B:GLY42
|
4.7
|
17.8
|
1.0
|
C3
|
B:BRX1143
|
4.8
|
33.3
|
0.3
|
CZ
|
B:TYR115
|
4.8
|
18.1
|
1.0
|
C
|
B:ILE112
|
4.8
|
13.0
|
1.0
|
C5
|
B:BRX1143
|
4.8
|
34.2
|
0.3
|
C9
|
B:CLM1144
|
4.9
|
36.9
|
0.5
|
C11
|
B:CLM1144
|
5.0
|
36.9
|
0.5
|
C5
|
B:CLM1144
|
5.0
|
37.6
|
0.5
|
|
Chlorine binding site 5 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 5 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl1143
b:26.1
occ:0.56
|
CL1
|
C:CLM1143
|
0.0
|
26.1
|
0.6
|
BR2
|
C:BRX1142
|
0.3
|
31.4
|
0.2
|
C1
|
C:BRX1142
|
2.0
|
33.2
|
0.2
|
C1
|
C:CLM1143
|
2.0
|
31.6
|
0.6
|
C2
|
C:CLM1143
|
2.9
|
33.2
|
0.6
|
C2
|
C:BRX1142
|
2.9
|
34.0
|
0.2
|
O2
|
C:CLM1143
|
2.9
|
33.1
|
0.6
|
O2
|
C:BRX1142
|
3.0
|
34.0
|
0.2
|
BR1
|
C:BRX1142
|
3.2
|
34.8
|
0.2
|
O
|
C:GLY42
|
3.2
|
19.2
|
1.0
|
CL2
|
C:CLM1143
|
3.2
|
33.1
|
0.6
|
O
|
C:ILE114
|
3.4
|
11.9
|
1.0
|
N
|
C:ILE114
|
3.4
|
9.9
|
1.0
|
C
|
C:GLY42
|
3.4
|
19.1
|
1.0
|
N
|
C:GLY42
|
3.6
|
15.7
|
1.0
|
CA
|
C:GLY113
|
3.7
|
10.1
|
1.0
|
CE1
|
C:TYR115
|
3.8
|
15.7
|
1.0
|
CA
|
C:GLY42
|
3.8
|
15.8
|
1.0
|
CZ
|
C:TYR115
|
3.9
|
20.2
|
1.0
|
CB
|
C:PRO40
|
3.9
|
15.9
|
1.0
|
C
|
C:GLY113
|
4.0
|
12.7
|
1.0
|
N2
|
C:CLM1143
|
4.0
|
36.0
|
0.6
|
N
|
C:PRO43
|
4.0
|
14.9
|
1.0
|
N2
|
C:BRX1142
|
4.0
|
34.9
|
0.2
|
C
|
C:ILE114
|
4.1
|
12.5
|
1.0
|
N
|
C:ILE41
|
4.1
|
13.1
|
1.0
|
OH
|
C:TYR115
|
4.1
|
19.6
|
1.0
|
CA
|
C:PRO40
|
4.2
|
13.8
|
1.0
|
CD1
|
C:TYR115
|
4.3
|
14.8
|
1.0
|
CA
|
C:ILE114
|
4.3
|
9.2
|
1.0
|
CE2
|
C:TYR115
|
4.4
|
14.8
|
1.0
|
CA
|
C:PRO43
|
4.4
|
14.2
|
1.0
|
C
|
C:PRO40
|
4.6
|
16.9
|
1.0
|
C
|
C:ILE41
|
4.6
|
18.7
|
1.0
|
CG
|
C:TYR115
|
4.7
|
13.0
|
1.0
|
CD
|
C:PRO43
|
4.8
|
16.4
|
1.0
|
CD2
|
C:TYR115
|
4.8
|
14.1
|
1.0
|
CA
|
C:ILE41
|
5.0
|
13.5
|
1.0
|
CB
|
C:ILE114
|
5.0
|
12.2
|
1.0
|
|
Chlorine binding site 6 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 6 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl1143
b:33.1
occ:0.56
|
CL2
|
C:CLM1143
|
0.0
|
33.1
|
0.6
|
BR1
|
C:BRX1142
|
0.2
|
34.8
|
0.2
|
C1
|
C:BRX1142
|
1.9
|
33.2
|
0.2
|
C1
|
C:CLM1143
|
2.0
|
31.6
|
0.6
|
C2
|
C:BRX1142
|
2.8
|
34.0
|
0.2
|
C2
|
C:CLM1143
|
3.0
|
33.2
|
0.6
|
CL1
|
C:CLM1143
|
3.2
|
26.1
|
0.6
|
N2
|
C:CLM1143
|
3.2
|
36.0
|
0.6
|
BR2
|
C:BRX1142
|
3.3
|
31.4
|
0.2
|
O2
|
C:BRX1142
|
3.4
|
34.0
|
0.2
|
CB
|
C:PRO43
|
3.5
|
15.9
|
1.0
|
N2
|
C:BRX1142
|
3.6
|
34.9
|
0.2
|
CA
|
C:GLY113
|
3.7
|
10.1
|
1.0
|
CA
|
C:PRO43
|
3.8
|
14.2
|
1.0
|
O2
|
C:CLM1143
|
3.9
|
33.1
|
0.6
|
CG2
|
C:THR88
|
4.0
|
16.3
|
1.0
|
OH
|
C:TYR115
|
4.0
|
19.6
|
1.0
|
CG2
|
C:ILE111
|
4.0
|
14.2
|
1.0
|
N
|
C:PRO43
|
4.3
|
14.9
|
1.0
|
C11
|
C:BRX1142
|
4.3
|
37.0
|
0.2
|
N
|
C:GLY113
|
4.3
|
11.0
|
1.0
|
C7
|
C:CLM1143
|
4.4
|
39.5
|
0.6
|
CG
|
C:PRO43
|
4.5
|
20.8
|
1.0
|
C3
|
C:CLM1143
|
4.6
|
38.7
|
0.6
|
C10
|
C:BRX1142
|
4.6
|
37.1
|
0.2
|
C6
|
C:BRX1142
|
4.6
|
36.7
|
0.2
|
CD
|
C:PRO43
|
4.6
|
16.4
|
1.0
|
C
|
C:GLY42
|
4.6
|
19.1
|
1.0
|
O
|
C:ILE112
|
4.6
|
15.6
|
1.0
|
C8
|
C:CLM1143
|
4.7
|
39.6
|
0.6
|
C3
|
C:BRX1142
|
4.7
|
35.7
|
0.2
|
C6
|
C:CLM1143
|
4.7
|
39.2
|
0.6
|
O
|
C:GLY42
|
4.7
|
19.2
|
1.0
|
CZ
|
C:TYR115
|
4.7
|
20.2
|
1.0
|
C5
|
C:BRX1142
|
4.8
|
36.4
|
0.2
|
C
|
C:ILE112
|
4.8
|
15.2
|
1.0
|
C5
|
C:CLM1143
|
4.9
|
39.3
|
0.6
|
C
|
C:GLY113
|
5.0
|
12.7
|
1.0
|
O5
|
C:BRX1142
|
5.0
|
36.5
|
0.2
|
|
Chlorine binding site 7 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 7 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1145
b:25.7
occ:0.68
|
CL1
|
D:CLM1145
|
0.0
|
25.7
|
0.7
|
BR2
|
D:BRX1144
|
0.3
|
32.2
|
0.1
|
C1
|
D:BRX1144
|
1.9
|
33.9
|
0.1
|
C1
|
D:CLM1145
|
2.0
|
30.6
|
0.7
|
C2
|
D:BRX1144
|
2.9
|
34.4
|
0.1
|
C2
|
D:CLM1145
|
2.9
|
31.4
|
0.7
|
O2
|
D:CLM1145
|
2.9
|
31.1
|
0.7
|
O2
|
D:BRX1144
|
3.0
|
34.3
|
0.1
|
BR1
|
D:BRX1144
|
3.1
|
35.2
|
0.1
|
O
|
D:GLY42
|
3.2
|
19.5
|
1.0
|
CL2
|
D:CLM1145
|
3.2
|
32.2
|
0.7
|
O
|
D:ILE114
|
3.4
|
13.4
|
1.0
|
C
|
D:GLY42
|
3.4
|
19.4
|
1.0
|
N
|
D:ILE114
|
3.4
|
9.6
|
1.0
|
N
|
D:GLY42
|
3.5
|
15.6
|
1.0
|
CA
|
D:GLY113
|
3.8
|
10.0
|
1.0
|
CB
|
D:PRO40
|
3.8
|
16.0
|
1.0
|
CE1
|
D:TYR115
|
3.8
|
15.0
|
1.0
|
CA
|
D:GLY42
|
3.8
|
15.7
|
1.0
|
CZ
|
D:TYR115
|
3.9
|
20.0
|
1.0
|
N
|
D:PRO43
|
4.0
|
14.8
|
1.0
|
N2
|
D:CLM1145
|
4.0
|
32.6
|
0.7
|
N
|
D:ILE41
|
4.0
|
13.3
|
1.0
|
N2
|
D:BRX1144
|
4.0
|
35.0
|
0.1
|
C
|
D:ILE114
|
4.1
|
13.4
|
1.0
|
C
|
D:GLY113
|
4.1
|
12.6
|
1.0
|
CA
|
D:PRO40
|
4.1
|
13.9
|
1.0
|
OH
|
D:TYR115
|
4.2
|
19.6
|
1.0
|
CD1
|
D:TYR115
|
4.2
|
14.7
|
1.0
|
CA
|
D:ILE114
|
4.4
|
9.1
|
1.0
|
CA
|
D:PRO43
|
4.4
|
13.7
|
1.0
|
C
|
D:PRO40
|
4.5
|
17.3
|
1.0
|
CE2
|
D:TYR115
|
4.5
|
14.4
|
1.0
|
C
|
D:ILE41
|
4.6
|
18.9
|
1.0
|
CD
|
D:PRO43
|
4.6
|
16.2
|
1.0
|
CG
|
D:TYR115
|
4.8
|
12.6
|
1.0
|
CD2
|
D:TYR115
|
4.8
|
13.3
|
1.0
|
CA
|
D:ILE41
|
4.9
|
13.4
|
1.0
|
|
Chlorine binding site 8 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 8 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1145
b:32.2
occ:0.68
|
CL2
|
D:CLM1145
|
0.0
|
32.2
|
0.7
|
BR1
|
D:BRX1144
|
0.3
|
35.2
|
0.1
|
C1
|
D:BRX1144
|
2.0
|
33.9
|
0.1
|
C1
|
D:CLM1145
|
2.0
|
30.6
|
0.7
|
C2
|
D:BRX1144
|
2.8
|
34.4
|
0.1
|
C2
|
D:CLM1145
|
2.9
|
31.4
|
0.7
|
CL1
|
D:CLM1145
|
3.2
|
25.7
|
0.7
|
N2
|
D:CLM1145
|
3.3
|
32.6
|
0.7
|
BR2
|
D:BRX1144
|
3.4
|
32.2
|
0.1
|
O2
|
D:BRX1144
|
3.4
|
34.3
|
0.1
|
N2
|
D:BRX1144
|
3.5
|
35.0
|
0.1
|
CB
|
D:PRO43
|
3.5
|
15.7
|
1.0
|
CA
|
D:GLY113
|
3.7
|
10.0
|
1.0
|
O2
|
D:CLM1145
|
3.8
|
31.1
|
0.7
|
CA
|
D:PRO43
|
3.8
|
13.7
|
1.0
|
CG2
|
D:ILE111
|
3.9
|
13.8
|
1.0
|
OH
|
D:TYR115
|
4.0
|
19.6
|
1.0
|
CG2
|
D:THR88
|
4.0
|
16.4
|
1.0
|
N
|
D:PRO43
|
4.2
|
14.8
|
1.0
|
C11
|
D:BRX1144
|
4.4
|
35.6
|
0.1
|
N
|
D:GLY113
|
4.4
|
10.7
|
1.0
|
CG
|
D:PRO43
|
4.5
|
20.6
|
1.0
|
C7
|
D:CLM1145
|
4.5
|
33.7
|
0.7
|
CD
|
D:PRO43
|
4.5
|
16.2
|
1.0
|
C
|
D:GLY42
|
4.6
|
19.4
|
1.0
|
C3
|
D:CLM1145
|
4.7
|
34.5
|
0.7
|
C3
|
D:BRX1144
|
4.7
|
35.5
|
0.1
|
O
|
D:GLY42
|
4.7
|
19.5
|
1.0
|
C6
|
D:BRX1144
|
4.7
|
35.6
|
0.1
|
C8
|
D:CLM1145
|
4.7
|
33.6
|
0.7
|
C10
|
D:BRX1144
|
4.7
|
35.7
|
0.1
|
C6
|
D:CLM1145
|
4.7
|
33.9
|
0.7
|
CZ
|
D:TYR115
|
4.7
|
20.0
|
1.0
|
O
|
D:ILE112
|
4.8
|
14.3
|
1.0
|
C5
|
D:BRX1144
|
4.8
|
35.8
|
0.1
|
C
|
D:ILE112
|
4.9
|
14.6
|
1.0
|
C5
|
D:CLM1145
|
5.0
|
34.9
|
0.7
|
C
|
D:GLY113
|
5.0
|
12.6
|
1.0
|
|
Chlorine binding site 9 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 9 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl1143
b:35.7
occ:0.59
|
CL1
|
E:CLM1143
|
0.0
|
35.7
|
0.6
|
BR2
|
E:BRX1142
|
0.2
|
26.0
|
0.2
|
C1
|
E:BRX1142
|
1.9
|
28.2
|
0.2
|
C1
|
E:CLM1143
|
2.0
|
35.5
|
0.6
|
C2
|
E:CLM1143
|
2.9
|
35.8
|
0.6
|
C2
|
E:BRX1142
|
2.9
|
29.9
|
0.2
|
O2
|
E:CLM1143
|
3.0
|
34.9
|
0.6
|
O2
|
E:BRX1142
|
3.1
|
30.0
|
0.2
|
BR1
|
E:BRX1142
|
3.1
|
29.3
|
0.2
|
CL2
|
E:CLM1143
|
3.2
|
38.1
|
0.6
|
O
|
E:GLY42
|
3.3
|
19.9
|
1.0
|
C
|
E:GLY42
|
3.4
|
19.8
|
1.0
|
N
|
E:ILE114
|
3.4
|
9.9
|
1.0
|
O
|
E:ILE114
|
3.5
|
13.6
|
1.0
|
N
|
E:GLY42
|
3.6
|
16.1
|
1.0
|
CA
|
E:GLY113
|
3.7
|
10.3
|
1.0
|
CE1
|
E:TYR115
|
3.8
|
15.6
|
1.0
|
CA
|
E:GLY42
|
3.9
|
16.3
|
1.0
|
N
|
E:PRO43
|
3.9
|
15.2
|
1.0
|
CB
|
E:PRO40
|
3.9
|
16.3
|
1.0
|
CZ
|
E:TYR115
|
3.9
|
20.1
|
1.0
|
C
|
E:GLY113
|
4.0
|
13.0
|
1.0
|
N2
|
E:CLM1143
|
4.0
|
37.0
|
0.6
|
N2
|
E:BRX1142
|
4.0
|
31.5
|
0.2
|
C
|
E:ILE114
|
4.1
|
13.8
|
1.0
|
N
|
E:ILE41
|
4.2
|
13.5
|
1.0
|
OH
|
E:TYR115
|
4.2
|
20.0
|
1.0
|
CA
|
E:PRO40
|
4.3
|
14.3
|
1.0
|
CA
|
E:PRO43
|
4.3
|
14.1
|
1.0
|
CD1
|
E:TYR115
|
4.3
|
15.1
|
1.0
|
CA
|
E:ILE114
|
4.4
|
9.6
|
1.0
|
CE2
|
E:TYR115
|
4.5
|
14.8
|
1.0
|
CD
|
E:PRO43
|
4.6
|
16.6
|
1.0
|
C
|
E:PRO40
|
4.6
|
17.7
|
1.0
|
C
|
E:ILE41
|
4.7
|
19.1
|
1.0
|
CG
|
E:TYR115
|
4.8
|
13.0
|
1.0
|
CB
|
E:PRO43
|
4.9
|
16.1
|
1.0
|
CD2
|
E:TYR115
|
4.9
|
13.7
|
1.0
|
|
Chlorine binding site 10 out
of 12 in 2jkl
Go back to
Chlorine Binding Sites List in 2jkl
Chlorine binding site 10 out
of 12 in the Drae Adhesin in Complex with Bromamphenicol
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Drae Adhesin in Complex with Bromamphenicol within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl1143
b:38.1
occ:0.59
|
CL2
|
E:CLM1143
|
0.0
|
38.1
|
0.6
|
BR1
|
E:BRX1142
|
0.3
|
29.3
|
0.2
|
C1
|
E:BRX1142
|
2.0
|
28.2
|
0.2
|
C1
|
E:CLM1143
|
2.0
|
35.5
|
0.6
|
C2
|
E:BRX1142
|
2.9
|
29.9
|
0.2
|
C2
|
E:CLM1143
|
3.0
|
35.8
|
0.6
|
CL1
|
E:CLM1143
|
3.2
|
35.7
|
0.6
|
BR2
|
E:BRX1142
|
3.4
|
26.0
|
0.2
|
O2
|
E:BRX1142
|
3.4
|
30.0
|
0.2
|
N2
|
E:CLM1143
|
3.4
|
37.0
|
0.6
|
CB
|
E:PRO43
|
3.5
|
16.1
|
1.0
|
CA
|
E:GLY113
|
3.6
|
10.3
|
1.0
|
N2
|
E:BRX1142
|
3.7
|
31.5
|
0.2
|
O2
|
E:CLM1143
|
3.7
|
34.9
|
0.6
|
CG2
|
E:ILE111
|
3.8
|
14.4
|
1.0
|
CG2
|
E:THR88
|
3.8
|
16.7
|
1.0
|
CA
|
E:PRO43
|
3.8
|
14.1
|
1.0
|
OH
|
E:TYR115
|
4.0
|
20.0
|
1.0
|
N
|
E:GLY113
|
4.3
|
11.1
|
1.0
|
N
|
E:PRO43
|
4.3
|
15.2
|
1.0
|
C11
|
E:BRX1142
|
4.4
|
33.4
|
0.2
|
CG
|
E:PRO43
|
4.5
|
21.2
|
1.0
|
C7
|
E:CLM1143
|
4.5
|
34.1
|
0.6
|
CD
|
E:PRO43
|
4.6
|
16.6
|
1.0
|
C10
|
E:BRX1142
|
4.6
|
33.7
|
0.2
|
O
|
E:ILE112
|
4.6
|
14.8
|
1.0
|
C8
|
E:CLM1143
|
4.7
|
34.0
|
0.6
|
C
|
E:ILE112
|
4.7
|
14.9
|
1.0
|
C6
|
E:BRX1142
|
4.7
|
33.3
|
0.2
|
C3
|
E:CLM1143
|
4.7
|
37.2
|
0.6
|
C6
|
E:CLM1143
|
4.8
|
34.7
|
0.6
|
CZ
|
E:TYR115
|
4.8
|
20.1
|
1.0
|
C
|
E:GLY42
|
4.8
|
19.8
|
1.0
|
C3
|
E:BRX1142
|
4.8
|
32.7
|
0.2
|
O
|
E:GLY42
|
4.9
|
19.9
|
1.0
|
C5
|
E:BRX1142
|
4.9
|
33.1
|
0.2
|
C
|
E:GLY113
|
4.9
|
13.0
|
1.0
|
|
Reference:
D.M.Pettigrew,
P.Roversi,
S.G.Davies,
A.J.Russell,
S.M.Lea.
A Structural Study of the Interaction Between the Dr Haemagglutinin Drae and Derivatives of Chloramphenicol Acta Crystallogr.,Sect.D V. 65 513 2009.
ISSN: ISSN 0907-4449
PubMed: 19465765
DOI: 10.1107/S0907444909005113
Page generated: Sat Jul 20 08:58:30 2024
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