Chlorine in PDB 1n80: Bacteriophage T4 Baseplate Structural Protein GP8
Protein crystallography data
The structure of Bacteriophage T4 Baseplate Structural Protein GP8, PDB code: 1n80
was solved by
P.G.Leiman,
M.M.Shneider,
V.A.Kostyuchenko,
P.R.Chipman,
V.V.Mesyanzhinov,
M.G.Rossmann,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
39.11 /
2.45
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
66.869,
66.777,
82.158,
93.11,
101.28,
90.77
|
R / Rfree (%)
|
23.6 /
28.4
|
Chlorine Binding Sites:
Chlorine binding site 1 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 1 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl335
b:57.7
occ:1.00
|
N
|
A:TYR104
|
3.0
|
46.6
|
1.0
|
OG1
|
A:THR105
|
3.2
|
40.2
|
1.0
|
O
|
A:HOH447
|
3.2
|
39.6
|
1.0
|
N
|
A:THR105
|
3.2
|
45.8
|
1.0
|
CA
|
A:TYR104
|
3.4
|
47.8
|
1.0
|
C
|
A:TYR104
|
3.5
|
46.7
|
1.0
|
CA
|
A:ASP102
|
3.5
|
48.9
|
1.0
|
N
|
A:PRO103
|
3.5
|
45.2
|
1.0
|
CB
|
A:TYR104
|
3.5
|
49.6
|
1.0
|
CD
|
A:PRO103
|
3.6
|
44.7
|
1.0
|
C
|
A:ASP102
|
3.6
|
46.4
|
1.0
|
CB
|
A:THR105
|
3.7
|
44.0
|
1.0
|
CA
|
A:THR105
|
4.1
|
44.3
|
1.0
|
C
|
A:PRO103
|
4.1
|
44.8
|
1.0
|
CG
|
A:PRO103
|
4.1
|
45.0
|
1.0
|
CD2
|
A:TYR104
|
4.3
|
50.6
|
1.0
|
O
|
A:TYR104
|
4.3
|
46.0
|
1.0
|
CG
|
A:TYR104
|
4.3
|
49.7
|
1.0
|
O
|
A:ASP102
|
4.3
|
45.3
|
1.0
|
N
|
A:ASP102
|
4.3
|
49.5
|
1.0
|
CA
|
A:PRO103
|
4.4
|
44.5
|
1.0
|
CB
|
A:ASP102
|
4.5
|
48.8
|
1.0
|
OD2
|
A:ASP102
|
4.6
|
51.0
|
1.0
|
CG
|
A:ASP102
|
5.0
|
51.6
|
1.0
|
CB
|
A:PRO103
|
5.0
|
44.0
|
1.0
|
|
Chlorine binding site 2 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 2 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl336
b:51.9
occ:1.00
|
ND2
|
A:ASN26
|
2.9
|
27.8
|
1.0
|
OD1
|
A:ASN23
|
3.1
|
35.0
|
1.0
|
CG
|
A:LEU22
|
3.2
|
28.2
|
1.0
|
N
|
A:ASN23
|
3.5
|
27.7
|
1.0
|
C
|
A:LEU22
|
3.5
|
27.4
|
1.0
|
CD2
|
A:LEU22
|
3.5
|
25.3
|
1.0
|
O
|
A:LEU22
|
3.6
|
27.8
|
1.0
|
CA
|
A:ASN23
|
3.6
|
27.3
|
1.0
|
ND2
|
B:ASN35
|
3.6
|
54.9
|
1.0
|
CB
|
A:LEU22
|
3.7
|
27.0
|
1.0
|
CG
|
A:ASN26
|
3.8
|
28.2
|
1.0
|
CB
|
A:ASN26
|
3.8
|
24.5
|
1.0
|
OD1
|
B:ASN35
|
4.0
|
55.2
|
1.0
|
CG
|
A:ASN23
|
4.1
|
32.6
|
1.0
|
CA
|
A:LEU22
|
4.3
|
27.5
|
1.0
|
CG
|
B:ASN35
|
4.3
|
55.8
|
1.0
|
CD1
|
A:LEU22
|
4.4
|
26.5
|
1.0
|
CB
|
A:ASN23
|
4.5
|
29.5
|
1.0
|
O
|
A:HOH415
|
4.5
|
42.5
|
1.0
|
C
|
A:ASN23
|
4.8
|
26.3
|
1.0
|
O
|
A:GLU19
|
4.8
|
23.1
|
1.0
|
O
|
B:ASP33
|
4.8
|
74.6
|
1.0
|
OD1
|
A:ASN26
|
5.0
|
28.4
|
1.0
|
|
Chlorine binding site 3 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 3 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl337
b:71.5
occ:1.00
|
N
|
A:VAL65
|
3.0
|
31.4
|
1.0
|
CG2
|
A:VAL65
|
3.4
|
32.9
|
1.0
|
CB
|
A:SER64
|
3.4
|
33.4
|
1.0
|
CA
|
A:SER64
|
3.6
|
31.7
|
1.0
|
CB
|
A:VAL65
|
3.7
|
33.8
|
1.0
|
C
|
A:SER64
|
3.8
|
31.4
|
1.0
|
CA
|
A:VAL65
|
3.9
|
31.6
|
1.0
|
O
|
B:HOH414
|
4.3
|
58.8
|
1.0
|
OG
|
A:SER64
|
4.4
|
33.4
|
1.0
|
N
|
A:LEU66
|
4.8
|
35.1
|
1.0
|
C
|
A:VAL65
|
4.9
|
32.0
|
1.0
|
O
|
A:SER64
|
5.0
|
30.6
|
1.0
|
|
Chlorine binding site 4 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 4 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl338
b:65.0
occ:1.00
|
ND2
|
A:ASN26
|
3.2
|
27.8
|
1.0
|
CD2
|
A:LEU22
|
3.8
|
25.3
|
1.0
|
CD1
|
A:LEU22
|
3.9
|
26.5
|
1.0
|
OD1
|
A:ASN26
|
4.0
|
28.4
|
1.0
|
CG
|
A:ASN26
|
4.0
|
28.2
|
1.0
|
CG
|
A:LEU22
|
4.2
|
28.2
|
1.0
|
CB
|
A:PRO213
|
4.4
|
28.5
|
1.0
|
O
|
A:HOH374
|
4.5
|
39.7
|
1.0
|
CG
|
A:PRO213
|
4.7
|
30.1
|
1.0
|
CD
|
A:PRO213
|
4.9
|
31.0
|
1.0
|
|
Chlorine binding site 5 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 5 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl339
b:69.1
occ:1.00
|
O
|
A:HOH353
|
3.7
|
38.0
|
1.0
|
CE1
|
A:HIS305
|
3.7
|
37.8
|
1.0
|
CG2
|
A:VAL68
|
3.8
|
27.0
|
1.0
|
CB
|
A:VAL68
|
4.0
|
27.8
|
1.0
|
ND1
|
A:HIS305
|
4.1
|
38.0
|
1.0
|
CG1
|
A:VAL68
|
4.1
|
24.6
|
1.0
|
CA
|
A:VAL65
|
4.2
|
31.6
|
1.0
|
CG2
|
A:VAL65
|
4.2
|
32.9
|
1.0
|
NZ
|
B:LYS15
|
4.2
|
32.2
|
1.0
|
O
|
B:HOH361
|
4.3
|
62.3
|
1.0
|
CB
|
A:VAL65
|
4.6
|
33.8
|
1.0
|
CG1
|
A:VAL65
|
4.6
|
32.9
|
1.0
|
CE
|
B:LYS15
|
4.8
|
33.3
|
1.0
|
CD
|
B:LYS15
|
4.8
|
32.5
|
1.0
|
N
|
A:VAL65
|
4.9
|
31.4
|
1.0
|
NE2
|
A:HIS305
|
5.0
|
38.1
|
1.0
|
|
Chlorine binding site 6 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 6 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl340
b:61.9
occ:1.00
|
NH2
|
A:ARG202
|
3.2
|
25.4
|
1.0
|
O
|
A:HOH472
|
3.3
|
54.3
|
1.0
|
CD
|
A:ARG202
|
3.5
|
27.4
|
1.0
|
CB
|
A:ASN201
|
3.8
|
27.8
|
1.0
|
CZ
|
A:ARG202
|
4.2
|
25.3
|
1.0
|
NE
|
A:ARG202
|
4.3
|
29.4
|
1.0
|
NZ
|
A:LYS250
|
4.3
|
26.2
|
1.0
|
O
|
A:HOH395
|
4.5
|
47.2
|
1.0
|
CG
|
A:ASN201
|
4.6
|
30.7
|
1.0
|
CD
|
A:LYS250
|
4.6
|
32.6
|
1.0
|
CG
|
A:ARG202
|
4.6
|
25.9
|
1.0
|
CE
|
A:LYS250
|
4.7
|
31.0
|
1.0
|
ND2
|
A:ASN201
|
4.8
|
34.7
|
1.0
|
C
|
A:ASN201
|
5.0
|
26.3
|
1.0
|
O
|
A:ASN201
|
5.0
|
25.2
|
1.0
|
|
Chlorine binding site 7 out
of 32 in 1n80
Go back to
Chlorine Binding Sites List in 1n80
Chlorine binding site 7 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl341
b:46.1
occ:1.00
|
O
|
A:HOH400
|
3.0
|
41.2
|
1.0
|
N
|
A:SER84
|
3.1
|
18.0
|
1.0
|
OG
|
A:SER84
|
3.2
|
24.7
|
1.0
|
CB
|
A:SER84
|
3.5
|
19.3
|
1.0
|
CD
|
A:PRO83
|
3.5
|
18.7
|
1.0
|
N
|
A:PRO83
|
3.7
|
18.8
|
1.0
|
CB
|
A:PRO83
|
3.8
|
18.7
|
1.0
|
CB
|
A:LEU82
|
3.9
|
25.2
|
1.0
|
CA
|
A:SER84
|
3.9
|
20.0
|
1.0
|
C
|
A:PRO83
|
4.1
|
20.4
|
1.0
|
CA
|
A:PRO83
|
4.1
|
19.0
|
1.0
|
CG
|
A:PRO83
|
4.1
|
17.6
|
1.0
|
C
|
A:LEU82
|
4.3
|
20.5
|
1.0
|
CA
|
A:LEU82
|
4.7
|
22.9
|
1.0
|
CG
|
A:LEU82
|
4.8
|
28.6
|
1.0
|
CD1
|
A:LEU82
|
4.9
|
28.6
|
1.0
|
|
Chlorine binding site 8 out
of 32 in 1n80
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Chlorine Binding Sites List in 1n80
Chlorine binding site 8 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl342
b:53.2
occ:1.00
|
N
|
A:LYS282
|
3.1
|
35.2
|
1.0
|
O
|
A:HOH390
|
3.4
|
38.8
|
1.0
|
CG
|
A:MET303
|
3.5
|
33.0
|
1.0
|
CA
|
A:ALA281
|
3.7
|
31.4
|
1.0
|
CB
|
A:MET303
|
3.8
|
31.3
|
1.0
|
C
|
A:ALA281
|
3.9
|
32.8
|
1.0
|
O
|
A:LYS282
|
3.9
|
40.9
|
1.0
|
CA
|
A:MET303
|
3.9
|
29.9
|
1.0
|
CA
|
A:LYS282
|
4.1
|
38.3
|
1.0
|
CB
|
A:ALA281
|
4.1
|
30.8
|
1.0
|
CB
|
A:LYS282
|
4.3
|
36.7
|
1.0
|
CE
|
A:MET303
|
4.4
|
35.1
|
1.0
|
C
|
A:LYS282
|
4.5
|
40.4
|
1.0
|
SD
|
A:MET303
|
4.7
|
39.8
|
1.0
|
O
|
A:LEU302
|
4.8
|
27.3
|
1.0
|
N
|
A:MET303
|
4.8
|
30.0
|
1.0
|
O
|
A:GLU280
|
4.8
|
25.5
|
1.0
|
N
|
A:ARG304
|
4.9
|
30.7
|
1.0
|
N
|
A:ALA281
|
4.9
|
29.6
|
1.0
|
C
|
A:MET303
|
5.0
|
30.1
|
1.0
|
|
Chlorine binding site 9 out
of 32 in 1n80
Go back to
Chlorine Binding Sites List in 1n80
Chlorine binding site 9 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl343
b:62.1
occ:1.00
|
O
|
A:HOH468
|
3.1
|
65.0
|
1.0
|
O
|
A:HOH423
|
3.3
|
45.0
|
1.0
|
NH1
|
A:ARG17
|
3.7
|
42.1
|
1.0
|
CD
|
A:ARG17
|
3.8
|
34.9
|
1.0
|
CB
|
A:SER14
|
3.8
|
43.7
|
1.0
|
O
|
A:HOH419
|
3.9
|
65.0
|
1.0
|
CA
|
A:SER14
|
4.2
|
43.9
|
1.0
|
ND2
|
A:ASN245
|
4.5
|
26.0
|
1.0
|
CZ
|
A:ARG17
|
4.5
|
41.7
|
1.0
|
NE
|
A:ARG17
|
4.5
|
38.3
|
1.0
|
CG
|
A:ARG17
|
4.8
|
33.9
|
1.0
|
O
|
A:SER14
|
4.8
|
43.1
|
1.0
|
CD
|
A:LYS243
|
4.9
|
30.9
|
1.0
|
|
Chlorine binding site 10 out
of 32 in 1n80
Go back to
Chlorine Binding Sites List in 1n80
Chlorine binding site 10 out
of 32 in the Bacteriophage T4 Baseplate Structural Protein GP8
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Bacteriophage T4 Baseplate Structural Protein GP8 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl344
b:0.6
occ:1.00
|
O
|
A:ARG241
|
3.4
|
32.4
|
1.0
|
NZ
|
A:LYS15
|
3.6
|
51.8
|
1.0
|
NZ
|
A:LYS243
|
3.9
|
35.9
|
1.0
|
CE
|
A:LYS15
|
3.9
|
50.7
|
1.0
|
C
|
A:ARG241
|
4.1
|
31.4
|
1.0
|
NH1
|
A:ARG132
|
4.2
|
39.3
|
1.0
|
O
|
A:TYR240
|
4.3
|
31.0
|
1.0
|
CA
|
A:ARG241
|
4.3
|
31.9
|
1.0
|
CE
|
A:LYS243
|
4.5
|
35.6
|
1.0
|
NH2
|
A:ARG132
|
4.6
|
39.9
|
1.0
|
CZ
|
A:ARG132
|
4.7
|
39.1
|
1.0
|
CG
|
A:LYS243
|
4.9
|
30.8
|
1.0
|
|
Reference:
P.G.Leiman,
M.M.Shneider,
V.A.Kostyuchenko,
P.R.Chipman,
V.V.Mesyanzhinov,
M.G.Rossmann.
Structure and Location of Gene Product 8 in the Bacteriophage T4 Baseplate J.Mol.Biol. V. 328 821 2003.
ISSN: ISSN 0022-2836
PubMed: 12729757
DOI: 10.1016/S0022-2836(03)00366-8
Page generated: Sat Jul 20 00:21:29 2024
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