Zinc in PDB 2yjp: Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Protein crystallography data
The structure of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae, PDB code: 2yjp
was solved by
H.Bulut,
S.Moniot,
F.Scheffel,
S.Gathmann,
A.Licht,
W.Saenger,
E.Schneider,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
47.18 /
2.26
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
58.710,
91.590,
158.300,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.472 /
23.274
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
(pdb code 2yjp). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 8 binding sites of Zinc where determined in the
Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae, PDB code: 2yjp:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Zinc binding site 1 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 1 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1270
b:22.5
occ:1.00
|
O
|
A:HOH2078
|
1.8
|
25.4
|
1.0
|
OE2
|
A:GLU178
|
2.1
|
28.9
|
1.0
|
ND1
|
A:HIS176
|
2.1
|
27.5
|
1.0
|
CD
|
A:GLU178
|
2.9
|
27.1
|
1.0
|
CE1
|
A:HIS176
|
2.9
|
22.8
|
1.0
|
OE1
|
A:GLU178
|
3.0
|
18.3
|
1.0
|
CG
|
A:HIS176
|
3.1
|
21.8
|
1.0
|
CB
|
A:HIS176
|
3.6
|
20.0
|
1.0
|
CA
|
A:HIS176
|
3.8
|
23.3
|
1.0
|
O
|
A:SER175
|
4.0
|
26.1
|
1.0
|
NE2
|
A:HIS176
|
4.1
|
22.5
|
1.0
|
CD2
|
A:HIS176
|
4.2
|
24.5
|
1.0
|
CG
|
A:GLU178
|
4.3
|
29.0
|
1.0
|
CB
|
A:MET152
|
4.5
|
24.2
|
1.0
|
CG
|
A:MET152
|
4.6
|
25.9
|
1.0
|
O
|
A:HOH2028
|
4.7
|
30.3
|
1.0
|
N
|
A:HIS176
|
4.7
|
23.0
|
1.0
|
C
|
A:SER175
|
4.7
|
25.0
|
1.0
|
C
|
A:HIS176
|
4.8
|
24.2
|
1.0
|
|
Zinc binding site 2 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 2 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1271
b:25.4
occ:1.00
|
O
|
A:HOH2097
|
2.2
|
19.8
|
1.0
|
OE1
|
A:GLU215
|
2.2
|
24.2
|
1.0
|
OE2
|
A:GLU215
|
2.4
|
31.0
|
1.0
|
CD
|
A:GLU215
|
2.7
|
22.7
|
1.0
|
CG
|
A:GLU215
|
4.2
|
19.4
|
1.0
|
|
Zinc binding site 3 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 3 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1272
b:29.7
occ:1.00
|
OD2
|
A:ASP185
|
2.0
|
21.4
|
1.0
|
OE2
|
B:GLU189
|
2.0
|
26.9
|
1.0
|
OE2
|
A:GLU98
|
2.1
|
39.6
|
1.0
|
OD1
|
B:ASP185
|
2.3
|
41.1
|
1.0
|
OE1
|
A:GLU98
|
2.5
|
34.5
|
1.0
|
CD
|
A:GLU98
|
2.6
|
33.2
|
1.0
|
CD
|
B:GLU189
|
2.7
|
24.2
|
1.0
|
CG
|
A:ASP185
|
2.8
|
22.7
|
1.0
|
OE1
|
B:GLU189
|
2.8
|
24.1
|
1.0
|
CB
|
A:ASP185
|
3.1
|
19.0
|
1.0
|
CG
|
B:ASP185
|
3.3
|
35.6
|
1.0
|
OD2
|
B:ASP185
|
3.6
|
41.0
|
1.0
|
OD1
|
A:ASP185
|
3.9
|
24.8
|
1.0
|
O
|
A:HOH2085
|
3.9
|
21.9
|
1.0
|
CG
|
B:GLN186
|
4.0
|
28.7
|
1.0
|
CG
|
A:GLU98
|
4.1
|
29.2
|
1.0
|
CG
|
B:GLU189
|
4.2
|
21.9
|
1.0
|
CA
|
A:ASP185
|
4.6
|
19.2
|
1.0
|
CB
|
B:ASP185
|
4.7
|
28.6
|
1.0
|
CB
|
B:GLN186
|
4.8
|
23.8
|
1.0
|
N
|
B:GLN186
|
4.9
|
22.9
|
1.0
|
|
Zinc binding site 4 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 4 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1273
b:85.9
occ:1.00
|
OD2
|
A:ASP196
|
2.5
|
40.7
|
1.0
|
OD1
|
A:ASP196
|
3.0
|
36.6
|
1.0
|
O
|
A:HOH2090
|
3.0
|
41.8
|
1.0
|
CG
|
A:ASP196
|
3.2
|
34.6
|
1.0
|
CB
|
A:ASP192
|
4.4
|
23.2
|
1.0
|
O
|
A:HOH2091
|
4.5
|
35.4
|
1.0
|
O
|
A:ASP192
|
4.7
|
20.9
|
1.0
|
CB
|
A:ASP196
|
4.7
|
28.3
|
1.0
|
CG
|
A:ASP192
|
4.7
|
31.1
|
1.0
|
OD2
|
A:ASP192
|
5.0
|
38.4
|
1.0
|
|
Zinc binding site 5 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 5 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1274
b:85.6
occ:1.00
|
OE1
|
A:GLU46
|
2.5
|
57.0
|
1.0
|
CD
|
A:GLU46
|
3.0
|
54.8
|
1.0
|
OE2
|
A:GLU46
|
3.1
|
59.4
|
1.0
|
O
|
A:HOH2003
|
3.3
|
49.1
|
1.0
|
CG
|
A:GLU46
|
4.2
|
47.7
|
1.0
|
|
Zinc binding site 6 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 6 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1275
b:61.4
occ:1.00
|
OE2
|
A:GLU189
|
1.9
|
36.8
|
1.0
|
O
|
A:HOH2084
|
2.4
|
16.2
|
1.0
|
O
|
A:HOH2086
|
2.5
|
38.0
|
1.0
|
CD
|
A:GLU189
|
2.9
|
36.3
|
1.0
|
OD2
|
B:ASP185
|
3.0
|
41.0
|
1.0
|
OE1
|
A:GLU189
|
3.1
|
32.2
|
1.0
|
O
|
A:HOH2085
|
3.4
|
21.9
|
1.0
|
CG
|
B:ASP185
|
3.5
|
35.6
|
1.0
|
CB
|
B:ASP185
|
3.6
|
28.6
|
1.0
|
N
|
B:ASP185
|
4.2
|
23.8
|
1.0
|
CG
|
A:GLU189
|
4.3
|
29.3
|
1.0
|
CA
|
B:ASP185
|
4.5
|
25.6
|
1.0
|
OD1
|
B:ASP185
|
4.6
|
41.1
|
1.0
|
CB
|
A:ASP185
|
4.9
|
19.0
|
1.0
|
N
|
A:ASP185
|
4.9
|
19.6
|
1.0
|
|
Zinc binding site 7 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 7 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 7 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn1270
b:26.4
occ:1.00
|
O
|
B:HOH2094
|
1.9
|
19.6
|
1.0
|
OE2
|
C:GLU178
|
2.0
|
24.8
|
1.0
|
ND1
|
C:HIS176
|
2.2
|
28.3
|
1.0
|
OE2
|
B:GLU215
|
2.3
|
32.6
|
1.0
|
OE1
|
B:GLU215
|
2.5
|
29.6
|
1.0
|
CD
|
B:GLU215
|
2.7
|
27.0
|
1.0
|
CD
|
C:GLU178
|
2.9
|
27.3
|
1.0
|
CE1
|
C:HIS176
|
3.0
|
26.1
|
1.0
|
OE1
|
C:GLU178
|
3.1
|
24.9
|
1.0
|
CG
|
C:HIS176
|
3.3
|
25.6
|
1.0
|
CB
|
C:HIS176
|
3.7
|
23.7
|
1.0
|
O
|
B:HOH2093
|
3.9
|
40.0
|
1.0
|
CA
|
C:HIS176
|
3.9
|
25.4
|
1.0
|
O
|
C:SER175
|
4.0
|
27.8
|
1.0
|
NE2
|
C:HIS176
|
4.2
|
24.5
|
1.0
|
CG
|
B:GLU215
|
4.2
|
20.2
|
1.0
|
CG
|
C:GLU178
|
4.3
|
28.8
|
1.0
|
CD2
|
C:HIS176
|
4.3
|
22.1
|
1.0
|
CB
|
C:MET152
|
4.5
|
28.2
|
1.0
|
CG
|
C:MET152
|
4.6
|
29.0
|
1.0
|
C
|
C:SER175
|
4.8
|
26.7
|
1.0
|
N
|
C:HIS176
|
4.8
|
25.7
|
1.0
|
CE
|
B:LYS214
|
4.8
|
26.1
|
1.0
|
C
|
C:HIS176
|
4.9
|
25.3
|
1.0
|
|
Zinc binding site 8 out
of 8 in 2yjp
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Zinc Binding Sites List in 2yjp
Zinc binding site 8 out
of 8 in the Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 8 of Crystal Structure of the Solute Receptors For L-Cysteine of Neisseria Gonorrhoeae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn1271
b:35.6
occ:1.00
|
O
|
C:HOH2084
|
1.8
|
34.0
|
1.0
|
OD2
|
C:ASP196
|
2.2
|
30.6
|
1.0
|
OD2
|
C:ASP192
|
2.4
|
31.6
|
1.0
|
OD1
|
C:ASP196
|
2.9
|
27.3
|
1.0
|
CG
|
C:ASP196
|
2.9
|
30.4
|
1.0
|
CG
|
C:ASP192
|
3.0
|
28.9
|
1.0
|
OD1
|
C:ASP192
|
3.1
|
33.2
|
1.0
|
O
|
C:HOH2085
|
4.1
|
35.9
|
1.0
|
O
|
C:ASP192
|
4.3
|
24.7
|
1.0
|
CB
|
C:ASP196
|
4.4
|
29.3
|
1.0
|
CB
|
C:ASP192
|
4.4
|
23.1
|
1.0
|
C
|
C:ASP192
|
4.8
|
23.0
|
1.0
|
|
Reference:
H.Bulut,
S.Moniot,
A.Licht,
F.Scheffel,
S.Gathmann,
W.Saenger,
E.Schneider.
Crystal Structures of Two Solute Receptors For L-Cystine and L-Cysteine, Respectively, of the Human Pathogen Neisseria Gonorrhoeae. J.Mol.Biol. V. 415 560 2012.
ISSN: ISSN 0022-2836
PubMed: 22138345
DOI: 10.1016/J.JMB.2011.11.030
Page generated: Thu Oct 17 05:51:54 2024
|