Chlorine in PDB 6qww: Hewl Lysozyme, Crystallized From CUCL2 Solution
Enzymatic activity of Hewl Lysozyme, Crystallized From CUCL2 Solution
All present enzymatic activity of Hewl Lysozyme, Crystallized From CUCL2 Solution:
3.2.1.17;
Protein crystallography data
The structure of Hewl Lysozyme, Crystallized From CUCL2 Solution, PDB code: 6qww
was solved by
A.S.Boikova,
P.V.Dorovatovskii,
Y.A.Dyakova,
K.B.Ilina,
I.P.Kuranova,
V.A.Lazarenko,
M.A.Marchenkova,
Y.V.Pisarevsky,
V.I.Timofeev,
M.V.Kovalchuk,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
27.84 /
1.35
|
Space group
|
P 43 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
78.739,
78.739,
36.774,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
16 /
19
|
Other elements in 6qww:
The structure of Hewl Lysozyme, Crystallized From CUCL2 Solution also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Hewl Lysozyme, Crystallized From CUCL2 Solution
(pdb code 6qww). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
Hewl Lysozyme, Crystallized From CUCL2 Solution, PDB code: 6qww:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 1 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl202
b:18.5
occ:1.00
|
OG
|
A:SER24
|
3.0
|
12.9
|
1.0
|
N
|
A:GLY26
|
3.1
|
8.1
|
1.0
|
CB
|
A:SER24
|
3.5
|
10.3
|
1.0
|
CA
|
A:GLY26
|
3.5
|
8.3
|
1.0
|
CA
|
A:GLN121
|
3.6
|
13.5
|
1.0
|
N
|
A:GLN121
|
3.9
|
13.1
|
1.0
|
CB
|
A:GLN121
|
4.1
|
17.0
|
1.0
|
N
|
A:LEU25
|
4.2
|
8.7
|
1.0
|
CG2
|
A:VAL120
|
4.2
|
14.4
|
1.0
|
O
|
A:VAL120
|
4.2
|
11.8
|
1.0
|
C
|
A:VAL120
|
4.2
|
12.2
|
1.0
|
CD1
|
A:ILE124
|
4.2
|
24.6
|
1.0
|
CG
|
A:GLN121
|
4.3
|
22.1
|
1.0
|
C
|
A:LEU25
|
4.3
|
8.5
|
1.0
|
C
|
A:SER24
|
4.4
|
8.7
|
1.0
|
CG1
|
A:ILE124
|
4.5
|
20.3
|
1.0
|
CA
|
A:SER24
|
4.6
|
9.6
|
1.0
|
C
|
A:GLY26
|
4.6
|
7.5
|
1.0
|
N
|
A:ASN27
|
4.7
|
7.9
|
1.0
|
CA
|
A:LEU25
|
4.7
|
8.2
|
1.0
|
O
|
A:SER24
|
4.8
|
9.4
|
1.0
|
C
|
A:GLN121
|
4.9
|
11.9
|
1.0
|
CB
|
A:VAL120
|
5.0
|
12.8
|
1.0
|
CB
|
A:LEU25
|
5.0
|
8.9
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 2 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl203
b:20.0
occ:1.00
|
O
|
A:HOH423
|
3.0
|
24.6
|
1.0
|
N
|
A:THR69
|
3.0
|
13.3
|
1.0
|
O
|
A:THR69
|
3.1
|
16.9
|
1.0
|
O
|
A:HOH358
|
3.2
|
15.1
|
1.0
|
N
|
A:ARG68
|
3.5
|
12.9
|
1.0
|
C
|
A:THR69
|
3.5
|
14.3
|
1.0
|
OG
|
A:SER72
|
3.5
|
23.6
|
1.0
|
C
|
A:GLY67
|
3.6
|
13.2
|
1.0
|
CA
|
A:GLY67
|
3.7
|
14.6
|
1.0
|
CA
|
A:THR69
|
3.7
|
12.8
|
1.0
|
OD1
|
A:ASN65
|
3.7
|
16.4
|
1.0
|
N
|
A:GLY67
|
3.7
|
12.9
|
1.0
|
O
|
A:HOH389
|
3.9
|
10.3
|
0.5
|
CB
|
A:THR69
|
4.1
|
13.2
|
1.0
|
C
|
A:ARG68
|
4.1
|
14.7
|
1.0
|
O
|
A:GLY67
|
4.2
|
17.4
|
1.0
|
CA
|
A:ARG68
|
4.2
|
12.4
|
1.0
|
O
|
A:HOH341
|
4.2
|
18.6
|
0.5
|
OD1
|
A:ASP66
|
4.3
|
10.2
|
1.0
|
N
|
A:PRO70
|
4.4
|
15.0
|
1.0
|
O
|
A:HOH420
|
4.6
|
29.2
|
1.0
|
CU
|
A:CU208
|
4.6
|
35.1
|
0.7
|
OG1
|
A:THR69
|
4.7
|
13.0
|
1.0
|
CL
|
A:CL207
|
4.8
|
31.7
|
0.5
|
C
|
A:ASP66
|
4.8
|
12.4
|
1.0
|
CB
|
A:SER72
|
4.8
|
23.6
|
1.0
|
N
|
A:ASP66
|
4.9
|
10.7
|
1.0
|
CG
|
A:ASN65
|
4.9
|
17.3
|
1.0
|
CA
|
A:PRO70
|
5.0
|
18.8
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 3 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl204
b:42.3
occ:1.00
|
O
|
A:HOH328
|
3.1
|
26.3
|
1.0
|
N
|
A:ILE88
|
3.6
|
12.4
|
1.0
|
O
|
A:HOH421
|
3.7
|
18.6
|
1.0
|
CG1
|
A:ILE88
|
3.8
|
11.5
|
1.0
|
CZ
|
A:PHE3
|
3.8
|
11.8
|
1.0
|
O
|
A:SER86
|
3.9
|
19.2
|
0.5
|
O
|
A:SER86
|
3.9
|
19.4
|
0.5
|
CG2
|
A:ILE88
|
4.0
|
12.6
|
1.0
|
CB
|
A:ALA11
|
4.1
|
9.1
|
1.0
|
CA
|
A:ASP87
|
4.1
|
15.0
|
1.0
|
CE1
|
A:HIS15
|
4.3
|
16.7
|
1.0
|
CB
|
A:ILE88
|
4.3
|
11.4
|
1.0
|
CE2
|
A:PHE3
|
4.4
|
12.2
|
1.0
|
C
|
A:ASP87
|
4.4
|
14.6
|
1.0
|
CA
|
A:ILE88
|
4.5
|
11.3
|
1.0
|
CD1
|
A:ILE88
|
4.6
|
11.7
|
1.0
|
C
|
A:SER86
|
4.8
|
16.3
|
0.5
|
O
|
A:HOH350
|
4.8
|
30.3
|
1.0
|
C
|
A:SER86
|
4.8
|
16.6
|
0.5
|
OD1
|
A:ASP87
|
4.9
|
17.4
|
1.0
|
N
|
A:ASP87
|
4.9
|
14.1
|
1.0
|
CE1
|
A:PHE3
|
4.9
|
12.5
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 4 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl205
b:25.7
occ:1.00
|
NZ
|
A:LYS33
|
3.6
|
22.8
|
1.0
|
CE2
|
A:PHE38
|
3.6
|
11.1
|
1.0
|
O
|
A:HOH395
|
3.8
|
28.4
|
1.0
|
CZ3
|
A:TRP123
|
3.9
|
12.3
|
1.0
|
CE
|
A:LYS33
|
4.0
|
18.5
|
1.0
|
CD
|
A:LYS33
|
4.1
|
15.3
|
1.0
|
CD
|
A:ARG5
|
4.1
|
15.2
|
1.0
|
CB
|
A:ARG5
|
4.2
|
14.5
|
1.0
|
CZ
|
A:PHE38
|
4.2
|
8.9
|
1.0
|
CD2
|
A:PHE38
|
4.6
|
11.0
|
1.0
|
CG
|
A:ARG5
|
4.6
|
15.1
|
1.0
|
NE
|
A:ARG5
|
4.6
|
14.8
|
1.0
|
CE3
|
A:TRP123
|
4.7
|
11.7
|
1.0
|
CH2
|
A:TRP123
|
4.8
|
14.6
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 5 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl206
b:13.3
occ:0.50
|
CU
|
A:CU209
|
3.0
|
10.3
|
0.5
|
NZ
|
A:LYS13
|
3.2
|
13.2
|
1.0
|
O
|
A:LEU129
|
3.5
|
3.7
|
0.5
|
O
|
A:HOH344
|
3.5
|
8.8
|
1.0
|
C
|
A:LEU129
|
3.7
|
9.7
|
0.5
|
C
|
A:LEU129
|
3.7
|
10.4
|
0.5
|
O
|
A:LEU129
|
3.8
|
4.6
|
0.5
|
CE
|
A:LYS13
|
3.9
|
13.3
|
1.0
|
CD
|
A:LYS13
|
4.0
|
11.9
|
1.0
|
CB
|
A:LEU129
|
4.0
|
12.1
|
1.0
|
CA
|
A:LEU129
|
4.5
|
10.7
|
1.0
|
O
|
A:HOH339
|
4.7
|
13.8
|
1.0
|
CG
|
A:LYS13
|
4.8
|
10.2
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 6qww
Go back to
Chlorine Binding Sites List in 6qww
Chlorine binding site 6 out
of 6 in the Hewl Lysozyme, Crystallized From CUCL2 Solution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Hewl Lysozyme, Crystallized From CUCL2 Solution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl207
b:31.7
occ:0.50
|
N
|
A:GLY71
|
2.8
|
21.0
|
1.0
|
O
|
A:HOH439
|
3.1
|
29.2
|
1.0
|
O
|
A:HOH423
|
3.3
|
24.6
|
1.0
|
CA
|
A:PRO70
|
3.6
|
18.8
|
1.0
|
C
|
A:PRO70
|
3.7
|
21.8
|
1.0
|
CA
|
A:GLY71
|
3.7
|
22.5
|
1.0
|
O
|
A:THR69
|
4.2
|
16.9
|
1.0
|
N
|
A:SER72
|
4.2
|
26.4
|
1.0
|
C
|
A:GLY71
|
4.3
|
23.5
|
1.0
|
CB
|
A:PRO70
|
4.6
|
24.6
|
1.0
|
N
|
A:PRO70
|
4.6
|
15.0
|
1.0
|
C
|
A:THR69
|
4.8
|
14.3
|
1.0
|
CL
|
A:CL203
|
4.8
|
20.0
|
1.0
|
O
|
A:PRO70
|
4.8
|
27.6
|
1.0
|
O
|
A:SER72
|
4.9
|
33.8
|
1.0
|
|
Reference:
A.S.Boikova,
P.V.Dorovatovskii,
Y.A.Dyakova,
K.B.Ilina,
I.P.Kuranova,
V.A.Lazarenko,
M.A.Marchenkova,
Y.V.Pisarevsky,
V.I.Timofeev,
M.V.Kovalchuk.
Hewl Lysozyme, Crystallized From Different Chlorides To Be Published.
Page generated: Mon Jul 29 14:10:04 2024
|