Chlorine in PDB 4jet: 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
Protein crystallography data
The structure of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis, PDB code: 4jet
was solved by
R.Kumar,
S.Lovell,
K.P.Battaile,
M.Rivera,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
38.62 /
2.20
|
|
Space group
|
C 1 2 1
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
139.369,
69.559,
232.317,
90.00,
100.12,
90.00
|
|
R / Rfree (%)
|
16.6 /
22.3
|
Other elements in 4jet:
The structure of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
(pdb code 4jet). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 10 binding sites of Chlorine where determined in the
2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis, PDB code: 4jet:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 1 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl202
b:51.3
occ:1.00
|
FE
|
A:HEM201
|
3.0
|
27.9
|
1.0
|
|
NH1
|
A:ARG40
|
3.1
|
28.0
|
1.0
|
|
CD
|
A:ARG40
|
3.3
|
44.2
|
1.0
|
|
ND
|
A:HEM201
|
3.4
|
19.4
|
1.0
|
|
NC
|
A:HEM201
|
3.5
|
20.3
|
1.0
|
|
CE
|
A:MET147
|
3.6
|
27.8
|
1.0
|
|
NH1
|
A:ARG144
|
3.6
|
32.4
|
1.0
|
|
NB
|
A:HEM201
|
3.7
|
19.5
|
1.0
|
|
NA
|
A:HEM201
|
3.7
|
28.5
|
1.0
|
|
C1D
|
A:HEM201
|
4.1
|
28.9
|
1.0
|
|
CD1
|
A:ILE30
|
4.1
|
25.9
|
1.0
|
|
C4D
|
A:HEM201
|
4.1
|
30.7
|
1.0
|
|
CZ
|
A:ARG40
|
4.1
|
35.7
|
1.0
|
|
C4C
|
A:HEM201
|
4.1
|
17.9
|
1.0
|
|
NE
|
A:ARG40
|
4.2
|
37.9
|
1.0
|
|
C1C
|
A:HEM201
|
4.2
|
13.0
|
1.0
|
|
C1A
|
A:HEM201
|
4.3
|
20.9
|
1.0
|
|
C4B
|
A:HEM201
|
4.3
|
27.4
|
1.0
|
|
CB
|
A:ARG40
|
4.4
|
38.4
|
1.0
|
|
CHD
|
A:HEM201
|
4.4
|
23.5
|
1.0
|
|
CG
|
A:ARG40
|
4.4
|
38.8
|
1.0
|
|
C4A
|
A:HEM201
|
4.4
|
28.0
|
1.0
|
|
CHA
|
A:HEM201
|
4.5
|
18.6
|
1.0
|
|
C1B
|
A:HEM201
|
4.5
|
25.1
|
1.0
|
|
CHC
|
A:HEM201
|
4.5
|
25.0
|
1.0
|
|
CZ
|
A:ARG144
|
4.6
|
29.9
|
1.0
|
|
CA
|
A:ARG40
|
4.7
|
29.0
|
1.0
|
|
NH2
|
A:ARG144
|
4.7
|
33.4
|
1.0
|
|
CHB
|
A:HEM201
|
4.8
|
27.9
|
1.0
|
|
SD
|
A:MET147
|
4.9
|
27.3
|
1.0
|
|
CG2
|
A:ILE30
|
5.0
|
26.4
|
1.0
|
|
C3D
|
A:HEM201
|
5.0
|
27.1
|
1.0
|
|
C2D
|
A:HEM201
|
5.0
|
23.5
|
1.0
|
|
Chlorine binding site 2 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 2 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl202
b:50.2
occ:1.00
|
FE
|
B:HEM201
|
3.1
|
26.7
|
1.0
|
|
NH1
|
B:ARG40
|
3.2
|
23.1
|
1.0
|
|
ND
|
B:HEM201
|
3.4
|
30.9
|
1.0
|
|
NC
|
B:HEM201
|
3.6
|
22.7
|
1.0
|
|
NH1
|
B:ARG144
|
3.6
|
33.0
|
1.0
|
|
NA
|
B:HEM201
|
3.7
|
28.6
|
1.0
|
|
CE
|
B:MET147
|
3.7
|
26.4
|
1.0
|
|
NB
|
B:HEM201
|
3.9
|
23.6
|
1.0
|
|
CD1
|
B:ILE30
|
3.9
|
26.8
|
1.0
|
|
C1D
|
B:HEM201
|
4.0
|
29.4
|
1.0
|
|
C4D
|
B:HEM201
|
4.0
|
29.3
|
1.0
|
|
C4C
|
B:HEM201
|
4.1
|
21.9
|
1.0
|
|
CG
|
B:ARG40
|
4.1
|
37.9
|
1.0
|
|
CD
|
B:ARG40
|
4.2
|
27.7
|
1.0
|
|
C1A
|
B:HEM201
|
4.2
|
28.6
|
1.0
|
|
C1C
|
B:HEM201
|
4.3
|
25.8
|
1.0
|
|
CZ
|
B:ARG40
|
4.3
|
31.1
|
1.0
|
|
CHD
|
B:HEM201
|
4.3
|
30.3
|
1.0
|
|
CHA
|
B:HEM201
|
4.3
|
30.0
|
1.0
|
|
CB
|
B:ARG40
|
4.4
|
33.1
|
1.0
|
|
CZ
|
B:ARG144
|
4.5
|
32.3
|
1.0
|
|
C4A
|
B:HEM201
|
4.5
|
25.4
|
1.0
|
|
C4B
|
B:HEM201
|
4.5
|
28.0
|
1.0
|
|
NH2
|
B:ARG144
|
4.6
|
37.6
|
1.0
|
|
C1B
|
B:HEM201
|
4.6
|
25.0
|
1.0
|
|
CHC
|
B:HEM201
|
4.7
|
23.9
|
1.0
|
|
NE
|
B:ARG40
|
4.7
|
33.7
|
1.0
|
|
CA
|
B:ARG40
|
4.9
|
25.0
|
1.0
|
|
CHB
|
B:HEM201
|
4.9
|
24.5
|
1.0
|
|
CG2
|
B:ILE30
|
4.9
|
26.0
|
1.0
|
|
SD
|
B:MET147
|
5.0
|
27.8
|
1.0
|
|
C2D
|
B:HEM201
|
5.0
|
27.4
|
1.0
|
|
C3D
|
B:HEM201
|
5.0
|
32.1
|
1.0
|
|
Chlorine binding site 3 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 3 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl202
b:40.1
occ:1.00
|
FE
|
C:HEM201
|
2.7
|
22.9
|
1.0
|
|
NH1
|
C:ARG40
|
3.0
|
21.1
|
1.0
|
|
ND
|
C:HEM201
|
3.0
|
18.9
|
1.0
|
|
NC
|
C:HEM201
|
3.3
|
21.4
|
1.0
|
|
NA
|
C:HEM201
|
3.5
|
29.1
|
1.0
|
|
NB
|
C:HEM201
|
3.5
|
18.1
|
1.0
|
|
NH1
|
C:ARG144
|
3.7
|
32.0
|
1.0
|
|
C1D
|
C:HEM201
|
3.8
|
29.2
|
1.0
|
|
C4D
|
C:HEM201
|
3.8
|
26.9
|
1.0
|
|
CD
|
C:ARG40
|
3.8
|
27.5
|
1.0
|
|
CG
|
C:ARG40
|
3.9
|
23.6
|
1.0
|
|
C4C
|
C:HEM201
|
4.0
|
23.3
|
1.0
|
|
CE
|
C:MET147
|
4.0
|
29.7
|
1.0
|
|
C1A
|
C:HEM201
|
4.0
|
23.8
|
1.0
|
|
C1C
|
C:HEM201
|
4.1
|
19.6
|
1.0
|
|
CZ
|
C:ARG40
|
4.1
|
28.2
|
1.0
|
|
CHD
|
C:HEM201
|
4.1
|
21.8
|
1.0
|
|
CB
|
C:ARG40
|
4.2
|
22.8
|
1.0
|
|
CHA
|
C:HEM201
|
4.2
|
22.4
|
1.0
|
|
C4B
|
C:HEM201
|
4.2
|
24.7
|
1.0
|
|
C4A
|
C:HEM201
|
4.2
|
21.9
|
1.0
|
|
C1B
|
C:HEM201
|
4.3
|
24.1
|
1.0
|
|
CD1
|
C:ILE30
|
4.4
|
30.6
|
1.0
|
|
CHC
|
C:HEM201
|
4.4
|
18.7
|
1.0
|
|
NE
|
C:ARG40
|
4.4
|
20.4
|
1.0
|
|
CZ
|
C:ARG144
|
4.6
|
24.4
|
1.0
|
|
CHB
|
C:HEM201
|
4.6
|
25.9
|
1.0
|
|
NH2
|
C:ARG144
|
4.7
|
34.9
|
1.0
|
|
C2D
|
C:HEM201
|
4.8
|
25.1
|
1.0
|
|
C3D
|
C:HEM201
|
4.8
|
27.8
|
1.0
|
|
OH
|
C:TYR75
|
4.8
|
23.0
|
1.0
|
|
CA
|
C:ARG40
|
4.9
|
21.9
|
1.0
|
|
C2A
|
C:HEM201
|
5.0
|
35.1
|
1.0
|
|
Chlorine binding site 4 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 4 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl202
b:50.5
occ:1.00
|
FE
|
D:HEM201
|
2.8
|
32.0
|
1.0
|
|
NH1
|
D:ARG40
|
3.0
|
36.6
|
1.0
|
|
ND
|
D:HEM201
|
3.3
|
29.4
|
1.0
|
|
NC
|
D:HEM201
|
3.4
|
29.7
|
1.0
|
|
NH1
|
D:ARG144
|
3.5
|
29.5
|
1.0
|
|
NA
|
D:HEM201
|
3.6
|
35.1
|
1.0
|
|
NB
|
D:HEM201
|
3.6
|
31.5
|
1.0
|
|
C4D
|
D:HEM201
|
3.9
|
35.1
|
1.0
|
|
C1D
|
D:HEM201
|
4.0
|
33.7
|
1.0
|
|
C4C
|
D:HEM201
|
4.1
|
33.0
|
1.0
|
|
CE
|
D:MET147
|
4.1
|
35.0
|
1.0
|
|
CG
|
D:ARG40
|
4.1
|
37.7
|
1.0
|
|
CD
|
D:ARG40
|
4.1
|
35.6
|
1.0
|
|
C1A
|
D:HEM201
|
4.1
|
34.0
|
1.0
|
|
C1C
|
D:HEM201
|
4.2
|
23.6
|
1.0
|
|
CZ
|
D:ARG40
|
4.2
|
46.3
|
1.0
|
|
CHA
|
D:HEM201
|
4.2
|
29.8
|
1.0
|
|
C4B
|
D:HEM201
|
4.3
|
28.2
|
1.0
|
|
CHD
|
D:HEM201
|
4.3
|
28.5
|
1.0
|
|
C4A
|
D:HEM201
|
4.3
|
31.5
|
1.0
|
|
CZ
|
D:ARG144
|
4.4
|
35.4
|
1.0
|
|
CB
|
D:ARG40
|
4.4
|
32.9
|
1.0
|
|
CD1
|
D:ILE30
|
4.4
|
36.7
|
1.0
|
|
C1B
|
D:HEM201
|
4.4
|
36.8
|
1.0
|
|
CHC
|
D:HEM201
|
4.4
|
24.1
|
1.0
|
|
NH2
|
D:ARG144
|
4.5
|
43.0
|
1.0
|
|
NE
|
D:ARG40
|
4.6
|
36.4
|
1.0
|
|
CHB
|
D:HEM201
|
4.7
|
30.1
|
1.0
|
|
OH
|
D:TYR75
|
4.9
|
28.7
|
1.0
|
|
C3D
|
D:HEM201
|
4.9
|
35.9
|
1.0
|
|
C2D
|
D:HEM201
|
4.9
|
32.6
|
1.0
|
|
Chlorine binding site 5 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 5 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl202
b:48.6
occ:1.00
|
FE
|
E:HEM201
|
2.6
|
29.4
|
1.0
|
|
ND
|
E:HEM201
|
3.2
|
27.9
|
1.0
|
|
NH1
|
E:ARG40
|
3.2
|
42.7
|
1.0
|
|
NC
|
E:HEM201
|
3.2
|
30.6
|
1.0
|
|
NA
|
E:HEM201
|
3.3
|
36.4
|
1.0
|
|
NB
|
E:HEM201
|
3.3
|
28.6
|
1.0
|
|
CD
|
E:ARG40
|
3.8
|
35.6
|
1.0
|
|
CG
|
E:ARG40
|
3.9
|
32.8
|
1.0
|
|
C1D
|
E:HEM201
|
3.9
|
31.2
|
1.0
|
|
C4C
|
E:HEM201
|
3.9
|
28.7
|
1.0
|
|
C1A
|
E:HEM201
|
3.9
|
35.5
|
1.0
|
|
C4A
|
E:HEM201
|
4.0
|
35.9
|
1.0
|
|
C4D
|
E:HEM201
|
4.0
|
41.8
|
1.0
|
|
C4B
|
E:HEM201
|
4.0
|
26.4
|
1.0
|
|
C1B
|
E:HEM201
|
4.0
|
32.0
|
1.0
|
|
NH1
|
E:ARG144
|
4.0
|
45.0
|
1.0
|
|
C1C
|
E:HEM201
|
4.0
|
28.4
|
1.0
|
|
CHD
|
E:HEM201
|
4.2
|
26.2
|
1.0
|
|
CHA
|
E:HEM201
|
4.2
|
38.9
|
1.0
|
|
CZ
|
E:ARG40
|
4.2
|
45.0
|
1.0
|
|
CB
|
E:ARG40
|
4.3
|
31.1
|
1.0
|
|
CE
|
E:MET147
|
4.3
|
28.0
|
1.0
|
|
CHB
|
E:HEM201
|
4.3
|
32.3
|
1.0
|
|
CHC
|
E:HEM201
|
4.3
|
24.6
|
1.0
|
|
NE
|
E:ARG40
|
4.5
|
33.2
|
1.0
|
|
OH
|
E:TYR75
|
4.5
|
26.1
|
1.0
|
|
CD1
|
E:ILE30
|
4.6
|
24.3
|
1.0
|
|
CZ
|
E:ARG144
|
4.7
|
43.9
|
1.0
|
|
NH2
|
E:ARG144
|
4.8
|
35.2
|
1.0
|
|
C3A
|
E:HEM201
|
4.9
|
40.6
|
1.0
|
|
C2A
|
E:HEM201
|
4.9
|
45.5
|
1.0
|
|
C3B
|
E:HEM201
|
5.0
|
31.4
|
1.0
|
|
Chlorine binding site 6 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 6 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cl202
b:50.6
occ:1.00
|
FE
|
F:HEM201
|
2.8
|
32.9
|
1.0
|
|
NH1
|
F:ARG40
|
3.0
|
32.7
|
1.0
|
|
ND
|
F:HEM201
|
3.1
|
33.3
|
1.0
|
|
NC
|
F:HEM201
|
3.5
|
29.3
|
1.0
|
|
NH1
|
F:ARG144
|
3.6
|
36.9
|
1.0
|
|
NA
|
F:HEM201
|
3.6
|
34.0
|
1.0
|
|
C1D
|
F:HEM201
|
3.7
|
38.0
|
1.0
|
|
C4D
|
F:HEM201
|
3.7
|
36.1
|
1.0
|
|
NB
|
F:HEM201
|
3.8
|
26.9
|
1.0
|
|
O
|
F:HOH323
|
3.8
|
46.7
|
1.0
|
|
C4C
|
F:HEM201
|
4.0
|
30.5
|
1.0
|
|
CG
|
F:ARG40
|
4.0
|
36.3
|
1.0
|
|
C1A
|
F:HEM201
|
4.0
|
28.1
|
1.0
|
|
CHD
|
F:HEM201
|
4.0
|
31.2
|
1.0
|
|
CD
|
F:ARG40
|
4.0
|
35.2
|
1.0
|
|
CHA
|
F:HEM201
|
4.2
|
36.6
|
1.0
|
|
CZ
|
F:ARG40
|
4.2
|
38.0
|
1.0
|
|
CD1
|
F:ILE30
|
4.2
|
38.4
|
1.0
|
|
CE
|
F:MET147
|
4.2
|
38.9
|
1.0
|
|
C1C
|
F:HEM201
|
4.3
|
28.7
|
1.0
|
|
C4A
|
F:HEM201
|
4.3
|
33.5
|
1.0
|
|
CB
|
F:ARG40
|
4.3
|
35.4
|
1.0
|
|
CZ
|
F:ARG144
|
4.4
|
34.6
|
1.0
|
|
C4B
|
F:HEM201
|
4.5
|
29.6
|
1.0
|
|
NE
|
F:ARG40
|
4.5
|
37.0
|
1.0
|
|
NH2
|
F:ARG144
|
4.6
|
50.7
|
1.0
|
|
C1B
|
F:HEM201
|
4.6
|
28.0
|
1.0
|
|
C2D
|
F:HEM201
|
4.6
|
34.1
|
1.0
|
|
C3D
|
F:HEM201
|
4.6
|
37.4
|
1.0
|
|
CHC
|
F:HEM201
|
4.7
|
28.5
|
1.0
|
|
OH
|
F:TYR75
|
4.8
|
29.8
|
1.0
|
|
CHB
|
F:HEM201
|
4.8
|
34.3
|
1.0
|
|
C2A
|
F:HEM201
|
5.0
|
35.1
|
1.0
|
|
Chlorine binding site 7 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 7 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Cl202
b:57.9
occ:1.00
|
NH1
|
G:ARG144
|
3.1
|
36.6
|
1.0
|
|
NH1
|
G:ARG40
|
3.3
|
32.4
|
1.0
|
|
FE
|
G:HEM201
|
3.3
|
34.7
|
1.0
|
|
ND
|
G:HEM201
|
3.5
|
30.5
|
1.0
|
|
NC
|
G:HEM201
|
3.8
|
31.4
|
1.0
|
|
CE
|
G:MET147
|
3.8
|
29.3
|
1.0
|
|
CZ
|
G:ARG144
|
3.9
|
38.2
|
1.0
|
|
NA
|
G:HEM201
|
4.0
|
41.1
|
1.0
|
|
CG
|
G:ARG40
|
4.0
|
35.4
|
1.0
|
|
C1D
|
G:HEM201
|
4.1
|
37.4
|
1.0
|
|
C4D
|
G:HEM201
|
4.1
|
34.9
|
1.0
|
|
NH2
|
G:ARG144
|
4.1
|
41.0
|
1.0
|
|
CD1
|
G:ILE30
|
4.1
|
40.0
|
1.0
|
|
NB
|
G:HEM201
|
4.2
|
31.5
|
1.0
|
|
CD
|
G:ARG40
|
4.3
|
42.6
|
1.0
|
|
C4C
|
G:HEM201
|
4.3
|
31.1
|
1.0
|
|
CZ
|
G:ARG40
|
4.3
|
37.3
|
1.0
|
|
C1A
|
G:HEM201
|
4.4
|
30.2
|
1.0
|
|
CHD
|
G:HEM201
|
4.4
|
30.6
|
1.0
|
|
CHA
|
G:HEM201
|
4.4
|
32.2
|
1.0
|
|
CB
|
G:ARG40
|
4.5
|
36.5
|
1.0
|
|
C1C
|
G:HEM201
|
4.5
|
28.1
|
1.0
|
|
C4A
|
G:HEM201
|
4.7
|
35.1
|
1.0
|
|
CG2
|
G:ILE30
|
4.7
|
31.2
|
1.0
|
|
NE
|
G:ARG40
|
4.7
|
42.4
|
1.0
|
|
C4B
|
G:HEM201
|
4.9
|
35.5
|
1.0
|
|
C2D
|
G:HEM201
|
4.9
|
35.1
|
1.0
|
|
CHC
|
G:HEM201
|
4.9
|
32.7
|
1.0
|
|
C3D
|
G:HEM201
|
5.0
|
34.9
|
1.0
|
|
C1B
|
G:HEM201
|
5.0
|
37.7
|
1.0
|
|
SD
|
G:MET147
|
5.0
|
30.0
|
1.0
|
|
Chlorine binding site 8 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 8 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Cl202
b:53.6
occ:1.00
|
FE
|
H:HEM201
|
2.7
|
30.6
|
1.0
|
|
NH1
|
H:ARG40
|
3.0
|
36.5
|
1.0
|
|
ND
|
H:HEM201
|
3.2
|
34.1
|
1.0
|
|
NC
|
H:HEM201
|
3.3
|
29.2
|
1.0
|
|
NA
|
H:HEM201
|
3.5
|
41.4
|
1.0
|
|
NB
|
H:HEM201
|
3.6
|
28.5
|
1.0
|
|
NH1
|
H:ARG144
|
3.7
|
38.8
|
1.0
|
|
C1D
|
H:HEM201
|
3.8
|
44.9
|
1.0
|
|
CE
|
H:MET147
|
3.8
|
32.2
|
1.0
|
|
C4D
|
H:HEM201
|
3.9
|
44.6
|
1.0
|
|
C4C
|
H:HEM201
|
3.9
|
32.3
|
1.0
|
|
CG
|
H:ARG40
|
3.9
|
38.9
|
1.0
|
|
C1A
|
H:HEM201
|
4.1
|
41.6
|
1.0
|
|
CD
|
H:ARG40
|
4.1
|
40.1
|
1.0
|
|
CHD
|
H:HEM201
|
4.1
|
38.9
|
1.0
|
|
C1C
|
H:HEM201
|
4.1
|
30.6
|
1.0
|
|
CZ
|
H:ARG40
|
4.2
|
34.9
|
1.0
|
|
CHA
|
H:HEM201
|
4.2
|
41.3
|
1.0
|
|
C4A
|
H:HEM201
|
4.2
|
33.0
|
1.0
|
|
C4B
|
H:HEM201
|
4.3
|
31.4
|
1.0
|
|
CB
|
H:ARG40
|
4.4
|
25.1
|
1.0
|
|
C1B
|
H:HEM201
|
4.4
|
40.3
|
1.0
|
|
CZ
|
H:ARG144
|
4.4
|
45.3
|
1.0
|
|
CD1
|
H:ILE30
|
4.5
|
41.7
|
1.0
|
|
CHC
|
H:HEM201
|
4.5
|
29.5
|
1.0
|
|
NH2
|
H:ARG144
|
4.5
|
40.6
|
1.0
|
|
NE
|
H:ARG40
|
4.6
|
39.6
|
1.0
|
|
CHB
|
H:HEM201
|
4.7
|
42.3
|
1.0
|
|
C2D
|
H:HEM201
|
4.7
|
40.5
|
1.0
|
|
OH
|
H:TYR75
|
4.7
|
26.3
|
1.0
|
|
C3D
|
H:HEM201
|
4.8
|
44.0
|
1.0
|
|
SD
|
H:MET147
|
4.9
|
34.8
|
1.0
|
|
C3C
|
H:HEM201
|
5.0
|
23.1
|
1.0
|
|
C2A
|
H:HEM201
|
5.0
|
47.6
|
1.0
|
|
Chlorine binding site 9 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 9 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Cl202
b:47.2
occ:1.00
|
FE
|
I:HEM201
|
2.6
|
22.9
|
1.0
|
|
NH1
|
I:ARG40
|
3.0
|
20.8
|
1.0
|
|
ND
|
I:HEM201
|
3.0
|
25.5
|
1.0
|
|
NC
|
I:HEM201
|
3.2
|
25.6
|
1.0
|
|
NA
|
I:HEM201
|
3.4
|
32.1
|
1.0
|
|
NB
|
I:HEM201
|
3.5
|
24.8
|
1.0
|
|
C1D
|
I:HEM201
|
3.7
|
32.9
|
1.0
|
|
NH1
|
I:ARG144
|
3.7
|
31.3
|
1.0
|
|
C4D
|
I:HEM201
|
3.7
|
35.4
|
1.0
|
|
CD
|
I:ARG40
|
3.7
|
33.0
|
1.0
|
|
C4C
|
I:HEM201
|
3.8
|
30.6
|
1.0
|
|
CHD
|
I:HEM201
|
4.0
|
29.2
|
1.0
|
|
C1A
|
I:HEM201
|
4.0
|
32.5
|
1.0
|
|
CE
|
I:MET147
|
4.0
|
24.6
|
1.0
|
|
C1C
|
I:HEM201
|
4.0
|
25.9
|
1.0
|
|
CG
|
I:ARG40
|
4.0
|
30.7
|
1.0
|
|
CZ
|
I:ARG40
|
4.1
|
36.9
|
1.0
|
|
CHA
|
I:HEM201
|
4.1
|
27.4
|
1.0
|
|
C4B
|
I:HEM201
|
4.2
|
23.9
|
1.0
|
|
C4A
|
I:HEM201
|
4.2
|
29.4
|
1.0
|
|
CB
|
I:ARG40
|
4.3
|
26.5
|
1.0
|
|
NE
|
I:ARG40
|
4.3
|
36.0
|
1.0
|
|
CHC
|
I:HEM201
|
4.3
|
21.2
|
1.0
|
|
C1B
|
I:HEM201
|
4.4
|
27.7
|
1.0
|
|
CD1
|
I:ILE30
|
4.5
|
26.9
|
1.0
|
|
CZ
|
I:ARG144
|
4.6
|
30.1
|
1.0
|
|
OH
|
I:TYR75
|
4.6
|
21.6
|
1.0
|
|
C2D
|
I:HEM201
|
4.6
|
31.2
|
1.0
|
|
CHB
|
I:HEM201
|
4.7
|
26.8
|
1.0
|
|
C3D
|
I:HEM201
|
4.7
|
35.0
|
1.0
|
|
O
|
I:HOH337
|
4.7
|
44.1
|
1.0
|
|
NH2
|
I:ARG144
|
4.8
|
34.8
|
1.0
|
|
C3C
|
I:HEM201
|
4.9
|
28.0
|
1.0
|
|
C2C
|
I:HEM201
|
5.0
|
27.4
|
1.0
|
|
Chlorine binding site 10 out
of 10 in 4jet
Go back to
Chlorine Binding Sites List in 4jet
Chlorine binding site 10 out
of 10 in the 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis
 Mono view
 Stereo pair view
|
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of 2.2A Resolution Structure of Holo Hemophore Hasa From Yersinia Pestis within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Cl202
b:61.1
occ:1.00
|
FE
|
J:HEM201
|
2.6
|
36.4
|
1.0
|
|
ND
|
J:HEM201
|
2.8
|
32.1
|
1.0
|
|
NH1
|
J:ARG40
|
3.1
|
41.1
|
1.0
|
|
NC
|
J:HEM201
|
3.3
|
36.9
|
1.0
|
|
NA
|
J:HEM201
|
3.3
|
42.2
|
1.0
|
|
C4D
|
J:HEM201
|
3.4
|
47.4
|
1.0
|
|
C1D
|
J:HEM201
|
3.6
|
39.7
|
1.0
|
|
NB
|
J:HEM201
|
3.6
|
33.1
|
1.0
|
|
NH1
|
J:ARG144
|
3.7
|
37.4
|
1.0
|
|
C1A
|
J:HEM201
|
3.8
|
35.7
|
1.0
|
|
CHA
|
J:HEM201
|
3.8
|
32.5
|
1.0
|
|
C4C
|
J:HEM201
|
3.9
|
32.9
|
1.0
|
|
CHD
|
J:HEM201
|
4.0
|
36.1
|
1.0
|
|
C1C
|
J:HEM201
|
4.1
|
29.9
|
1.0
|
|
CE
|
J:MET147
|
4.1
|
34.1
|
1.0
|
|
CG
|
J:ARG40
|
4.1
|
39.9
|
1.0
|
|
CD
|
J:ARG40
|
4.2
|
48.5
|
1.0
|
|
C4A
|
J:HEM201
|
4.2
|
36.6
|
1.0
|
|
CZ
|
J:ARG40
|
4.3
|
36.5
|
1.0
|
|
C4B
|
J:HEM201
|
4.3
|
32.1
|
1.0
|
|
C3D
|
J:HEM201
|
4.4
|
43.9
|
1.0
|
|
CB
|
J:ARG40
|
4.4
|
39.5
|
1.0
|
|
C2D
|
J:HEM201
|
4.5
|
33.6
|
1.0
|
|
C1B
|
J:HEM201
|
4.5
|
38.6
|
1.0
|
|
CHC
|
J:HEM201
|
4.5
|
31.9
|
1.0
|
|
CZ
|
J:ARG144
|
4.6
|
39.8
|
1.0
|
|
CD1
|
J:ILE30
|
4.6
|
41.0
|
1.0
|
|
NE
|
J:ARG40
|
4.7
|
50.0
|
1.0
|
|
OH
|
J:TYR75
|
4.7
|
33.0
|
1.0
|
|
CHB
|
J:HEM201
|
4.7
|
38.5
|
1.0
|
|
NH2
|
J:ARG144
|
4.8
|
48.8
|
1.0
|
|
C2A
|
J:HEM201
|
4.9
|
43.1
|
1.0
|
|
C3C
|
J:HEM201
|
4.9
|
34.2
|
1.0
|
|
Reference:
R.Kumar,
S.Lovell,
H.Matsumura,
K.P.Battaile,
P.Moenne-Loccoz,
M.Rivera.
The Hemophore Hasa From Yersinia Pestis (Hasayp) Coordinates Hemin with A Single Residue, TYR75, and with Minimal Conformational Change. Biochemistry V. 52 2705 2013.
ISSN: ISSN 0006-2960
PubMed: 23578210
DOI: 10.1021/BI400280Z
Page generated: Sun Jul 21 17:24:53 2024
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