Zinc in PDB 1k53: Monomeric Protein L B1 Domain with A G15A Mutation
Protein crystallography data
The structure of Monomeric Protein L B1 Domain with A G15A Mutation, PDB code: 1k53
was solved by
J.W.O'neill,
D.E.Kim,
K.Johnsen,
D.Baker,
K.Y.J.Zhang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
24.55 /
2.10
|
Space group
|
P 32 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
66.511,
66.511,
109.192,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
21.3 /
23.3
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Monomeric Protein L B1 Domain with A G15A Mutation
(pdb code 1k53). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 8 binding sites of Zinc where determined in the
Monomeric Protein L B1 Domain with A G15A Mutation, PDB code: 1k53:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Zinc binding site 1 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 1 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1001
b:39.1
occ:1.00
|
O
|
A:HOH2113
|
2.5
|
30.4
|
1.0
|
NE2
|
A:HIS-6
|
2.7
|
42.7
|
1.0
|
CD2
|
A:HIS-6
|
3.3
|
41.8
|
1.0
|
CE1
|
A:HIS-6
|
3.9
|
45.3
|
1.0
|
CB
|
A:MET-7
|
4.0
|
44.0
|
1.0
|
CG
|
A:MET-7
|
4.0
|
49.5
|
1.0
|
CG
|
A:HIS-6
|
4.6
|
41.2
|
1.0
|
ND1
|
A:HIS-6
|
4.9
|
42.4
|
1.0
|
|
Zinc binding site 2 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 2 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1002
b:21.2
occ:1.00
|
NE2
|
A:HIS-3
|
2.0
|
13.1
|
1.0
|
NE2
|
A:HIS-5
|
2.0
|
21.0
|
1.0
|
CD2
|
A:HIS-5
|
2.8
|
21.9
|
1.0
|
CE1
|
A:HIS-3
|
2.9
|
16.7
|
1.0
|
CD2
|
A:HIS-3
|
3.0
|
13.9
|
1.0
|
CE1
|
A:HIS-5
|
3.2
|
21.4
|
1.0
|
ND1
|
A:HIS-3
|
4.0
|
19.8
|
1.0
|
CG
|
A:HIS-5
|
4.0
|
20.8
|
1.0
|
CG
|
A:HIS-3
|
4.1
|
15.4
|
1.0
|
ND1
|
A:HIS-5
|
4.2
|
21.7
|
1.0
|
|
Zinc binding site 3 out
of 8 in 1k53
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Zinc Binding Sites List in 1k53
Zinc binding site 3 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1003
b:18.2
occ:1.00
|
ND1
|
A:HIS-2
|
2.1
|
14.6
|
1.0
|
OE2
|
A:GLU2
|
2.1
|
16.7
|
1.0
|
NE2
|
A:HIS-4
|
2.2
|
15.2
|
1.0
|
OE1
|
A:GLU27
|
2.2
|
20.1
|
1.0
|
OE2
|
A:GLU27
|
2.5
|
19.8
|
1.0
|
CD
|
A:GLU27
|
2.7
|
21.6
|
1.0
|
CD
|
A:GLU2
|
2.8
|
17.4
|
1.0
|
OE1
|
A:GLU2
|
2.9
|
15.5
|
1.0
|
CE1
|
A:HIS-2
|
3.0
|
14.3
|
1.0
|
CE1
|
A:HIS-4
|
3.1
|
15.7
|
1.0
|
CG
|
A:HIS-2
|
3.1
|
15.3
|
1.0
|
CD2
|
A:HIS-4
|
3.2
|
16.6
|
1.0
|
CB
|
A:HIS-2
|
3.5
|
16.8
|
1.0
|
CA
|
A:HIS-2
|
3.8
|
15.9
|
1.0
|
CB
|
A:PHE26
|
4.1
|
16.2
|
1.0
|
NE2
|
A:HIS-2
|
4.1
|
15.1
|
1.0
|
CG
|
A:GLU27
|
4.2
|
19.4
|
1.0
|
CD2
|
A:HIS-2
|
4.2
|
16.0
|
1.0
|
CG
|
A:GLU2
|
4.2
|
15.8
|
1.0
|
N
|
A:PHE26
|
4.2
|
16.5
|
1.0
|
ND1
|
A:HIS-4
|
4.2
|
15.0
|
1.0
|
CG
|
A:HIS-4
|
4.3
|
16.9
|
1.0
|
N
|
A:GLU27
|
4.4
|
17.5
|
1.0
|
N
|
A:HIS-1
|
4.4
|
16.2
|
1.0
|
CA
|
A:PHE26
|
4.7
|
17.3
|
1.0
|
C
|
A:HIS-2
|
4.7
|
16.9
|
1.0
|
CB
|
A:THR25
|
4.8
|
16.7
|
1.0
|
N
|
A:HIS-2
|
4.8
|
16.1
|
1.0
|
O
|
A:HIS-1
|
4.9
|
17.7
|
1.0
|
CB
|
A:GLU27
|
4.9
|
19.5
|
1.0
|
|
Zinc binding site 4 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 4 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1004
b:55.4
occ:1.00
|
NE2
|
A:HIS-2
|
2.4
|
15.1
|
1.0
|
O
|
A:HOH2117
|
3.1
|
16.8
|
1.0
|
CE1
|
A:HIS-2
|
3.2
|
14.3
|
1.0
|
CD2
|
A:HIS-2
|
3.6
|
16.0
|
1.0
|
O
|
A:HOH2004
|
3.8
|
22.2
|
1.0
|
CA
|
A:ALA0
|
4.0
|
22.9
|
1.0
|
CB
|
A:ALA0
|
4.3
|
24.0
|
1.0
|
ND1
|
A:HIS-2
|
4.4
|
14.6
|
1.0
|
N
|
A:ALA0
|
4.6
|
20.8
|
1.0
|
CG
|
A:HIS-2
|
4.6
|
15.3
|
1.0
|
NZ
|
A:LYS28
|
4.6
|
39.5
|
1.0
|
CG2
|
A:THR25
|
4.8
|
15.7
|
1.0
|
|
Zinc binding site 5 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 5 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1005
b:22.1
occ:1.00
|
NE2
|
A:HIS-1
|
2.0
|
19.2
|
1.0
|
CE1
|
A:HIS-1
|
2.8
|
19.6
|
1.0
|
CD2
|
A:HIS-1
|
3.1
|
19.2
|
1.0
|
ND1
|
A:HIS-1
|
4.0
|
20.4
|
1.0
|
CG
|
A:HIS-1
|
4.2
|
19.4
|
1.0
|
O
|
A:HIS-2
|
5.0
|
17.9
|
1.0
|
|
Zinc binding site 6 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 6 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1007
b:44.0
occ:1.00
|
OD1
|
A:ASP43
|
2.1
|
24.7
|
1.0
|
O
|
A:HOH2134
|
2.5
|
35.9
|
1.0
|
CG
|
A:ASP43
|
3.0
|
25.5
|
1.0
|
OD2
|
A:ASP43
|
3.1
|
26.3
|
1.0
|
CB
|
A:ASP43
|
4.3
|
23.9
|
1.0
|
O
|
A:HOH2135
|
4.4
|
25.7
|
1.0
|
CE
|
A:LYS42
|
4.5
|
41.5
|
1.0
|
NZ
|
A:LYS42
|
4.8
|
43.9
|
1.0
|
CD
|
A:LYS42
|
4.9
|
36.7
|
1.0
|
CA
|
A:ASP43
|
4.9
|
22.4
|
1.0
|
|
Zinc binding site 7 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 7 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 7 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn1006
b:17.2
occ:1.00
|
ND1
|
B:HIS-2
|
2.0
|
12.8
|
1.0
|
OE2
|
B:GLU2
|
2.1
|
17.9
|
1.0
|
NE2
|
B:HIS-4
|
2.1
|
14.8
|
1.0
|
OE1
|
B:GLU27
|
2.2
|
16.9
|
1.0
|
OE2
|
B:GLU27
|
2.7
|
16.7
|
1.0
|
CD
|
B:GLU27
|
2.8
|
17.3
|
1.0
|
CD
|
B:GLU2
|
2.8
|
17.2
|
1.0
|
OE1
|
B:GLU2
|
2.9
|
14.3
|
1.0
|
CE1
|
B:HIS-2
|
3.0
|
13.8
|
1.0
|
CE1
|
B:HIS-4
|
3.0
|
17.2
|
1.0
|
CG
|
B:HIS-2
|
3.1
|
13.8
|
1.0
|
CD2
|
B:HIS-4
|
3.1
|
11.3
|
1.0
|
CB
|
B:HIS-2
|
3.5
|
14.9
|
1.0
|
CA
|
B:HIS-2
|
3.8
|
15.1
|
1.0
|
CB
|
B:PHE26
|
4.1
|
16.6
|
1.0
|
NE2
|
B:HIS-2
|
4.1
|
14.8
|
1.0
|
ND1
|
B:HIS-4
|
4.2
|
14.4
|
1.0
|
CD2
|
B:HIS-2
|
4.2
|
14.9
|
1.0
|
CG
|
B:GLU2
|
4.2
|
17.4
|
1.0
|
CG
|
B:HIS-4
|
4.2
|
15.1
|
1.0
|
N
|
B:PHE26
|
4.3
|
15.5
|
1.0
|
CG
|
B:GLU27
|
4.3
|
16.5
|
1.0
|
N
|
B:HIS-1
|
4.4
|
15.5
|
1.0
|
N
|
B:GLU27
|
4.4
|
14.8
|
1.0
|
C
|
B:HIS-2
|
4.6
|
14.8
|
1.0
|
CA
|
B:PHE26
|
4.7
|
16.4
|
1.0
|
CB
|
B:THR25
|
4.7
|
16.3
|
1.0
|
N
|
B:HIS-2
|
4.7
|
14.9
|
1.0
|
O
|
B:HIS-1
|
4.9
|
16.9
|
1.0
|
CB
|
B:GLU27
|
4.9
|
15.2
|
1.0
|
|
Zinc binding site 8 out
of 8 in 1k53
Go back to
Zinc Binding Sites List in 1k53
Zinc binding site 8 out
of 8 in the Monomeric Protein L B1 Domain with A G15A Mutation
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 8 of Monomeric Protein L B1 Domain with A G15A Mutation within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn1008
b:55.2
occ:1.00
|
NE2
|
B:HIS-2
|
2.4
|
14.8
|
1.0
|
NZ
|
B:LYS28
|
3.0
|
24.4
|
1.0
|
CE1
|
B:HIS-2
|
3.2
|
13.8
|
1.0
|
CD2
|
B:HIS-2
|
3.5
|
14.9
|
1.0
|
O
|
B:HOH2041
|
3.8
|
23.7
|
1.0
|
O
|
B:HOH2001
|
3.9
|
52.6
|
1.0
|
CA
|
B:ALA0
|
4.0
|
22.6
|
1.0
|
CE
|
B:LYS28
|
4.0
|
33.9
|
1.0
|
CB
|
B:ALA0
|
4.3
|
23.4
|
1.0
|
ND1
|
B:HIS-2
|
4.4
|
12.8
|
1.0
|
O
|
B:HOH2099
|
4.4
|
32.8
|
1.0
|
CG
|
B:HIS-2
|
4.5
|
13.8
|
1.0
|
N
|
B:ALA0
|
4.6
|
21.2
|
1.0
|
CG2
|
B:THR25
|
4.9
|
11.9
|
1.0
|
|
Reference:
J.W.O'neill,
D.E.Kim,
K.Johnsen,
D.Baker,
K.Y.Zhang.
Single-Site Mutations Induce 3D Domain Swapping in the B1 Domain of Protein L From Peptostreptococcus Magnus. Structure V. 9 1017 2001.
ISSN: ISSN 0969-2126
PubMed: 11709166
DOI: 10.1016/S0969-2126(01)00667-0
Page generated: Sun Oct 13 04:05:21 2024
|