Argon in PDB 7q38: Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Protein crystallography data
The structure of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon, PDB code: 7q38
was solved by
I.Melnikov,
M.Rulev,
R.Astashkin,
K.Kovalev,
P.Carpentier,
V.Gordeliy,
A.Popov,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
83.02 /
1.65
|
Space group
|
C 2 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
115.657,
119.245,
36.393,
90,
90,
90
|
R / Rfree (%)
|
16.2 /
20.5
|
Argon Binding Sites:
Argon binding site 1 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 1 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 1 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar322
b:18.7
occ:0.83
|
CD1
|
A:LEU97
|
3.5
|
21.4
|
1.0
|
CZ2
|
A:TRP182
|
3.6
|
18.6
|
1.0
|
OG1
|
A:THR178
|
3.7
|
20.4
|
1.0
|
C
|
A:LEU93
|
3.7
|
15.8
|
1.0
|
O
|
A:LEU93
|
3.7
|
15.7
|
1.0
|
CB
|
A:LEU93
|
3.7
|
15.8
|
1.0
|
CG2
|
A:THR178
|
3.7
|
21.5
|
1.0
|
CE2
|
A:PHE219
|
3.8
|
19.9
|
1.0
|
CD2
|
A:LEU94
|
3.9
|
19.9
|
1.0
|
N
|
A:LEU94
|
4.0
|
17.5
|
1.0
|
CZ
|
A:PHE219
|
4.0
|
21.0
|
1.0
|
CE2
|
A:TRP182
|
4.0
|
16.4
|
1.0
|
CG
|
A:LEU97
|
4.1
|
18.6
|
1.0
|
O
|
A:HOH430
|
4.1
|
24.9
|
1.0
|
CA
|
A:LEU94
|
4.2
|
18.6
|
1.0
|
NE1
|
A:TRP182
|
4.2
|
18.5
|
1.0
|
CA
|
A:LEU93
|
4.3
|
15.9
|
1.0
|
CH2
|
A:TRP182
|
4.3
|
18.3
|
1.0
|
CB
|
A:THR178
|
4.3
|
20.2
|
1.0
|
CG
|
A:LEU94
|
4.5
|
17.2
|
1.0
|
CD2
|
A:PHE219
|
4.7
|
18.9
|
1.0
|
CD1
|
A:LEU152
|
4.8
|
21.2
|
1.0
|
CG
|
A:LEU93
|
4.9
|
17.8
|
1.0
|
CB
|
A:LEU94
|
5.0
|
18.1
|
1.0
|
CD2
|
A:LEU97
|
5.0
|
22.4
|
1.0
|
|
Argon binding site 2 out
of 47 in 7q38
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Argon Binding Sites List in 7q38
Argon binding site 2 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 2 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar323
b:19.7
occ:0.33
|
AR
|
A:AR360
|
2.6
|
21.5
|
0.2
|
CA
|
A:LEU15
|
3.7
|
18.6
|
1.0
|
C13
|
A:OLC312
|
3.8
|
44.8
|
0.8
|
O
|
A:ALA14
|
3.8
|
19.4
|
1.0
|
N
|
A:LEU15
|
3.9
|
18.5
|
1.0
|
C
|
A:ALA14
|
3.9
|
18.5
|
1.0
|
CB
|
A:ALA18
|
4.0
|
19.8
|
1.0
|
C15
|
A:OLC312
|
4.0
|
42.1
|
0.8
|
CD1
|
A:LEU15
|
4.1
|
21.1
|
1.0
|
AR
|
A:AR361
|
4.2
|
31.3
|
0.3
|
C14
|
A:OLC312
|
4.2
|
44.1
|
0.8
|
CB
|
A:LEU15
|
4.3
|
19.1
|
1.0
|
CB
|
A:ALA14
|
4.4
|
22.4
|
1.0
|
CA
|
A:ALA14
|
4.8
|
20.7
|
1.0
|
CG
|
A:LEU15
|
4.9
|
19.4
|
1.0
|
C
|
A:LEU15
|
4.9
|
19.4
|
1.0
|
C11
|
A:OLA315
|
4.9
|
49.1
|
1.0
|
|
Argon binding site 3 out
of 47 in 7q38
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Argon Binding Sites List in 7q38
Argon binding site 3 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 3 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar324
b:21.2
occ:0.63
|
C
|
A:LEU94
|
3.5
|
17.0
|
1.0
|
N
|
A:LEU95
|
3.6
|
16.6
|
1.0
|
CB
|
A:LEU94
|
3.6
|
18.1
|
1.0
|
O
|
A:LEU94
|
3.7
|
17.5
|
1.0
|
CA
|
A:LEU95
|
3.8
|
18.2
|
1.0
|
CG2
|
A:ILE108
|
3.8
|
23.1
|
1.0
|
O
|
A:ILE108
|
4.0
|
21.4
|
1.0
|
CB
|
A:ALA98
|
4.0
|
20.5
|
1.0
|
CB
|
A:LEU111
|
4.0
|
23.1
|
1.0
|
CG2
|
A:VAL112
|
4.1
|
24.9
|
1.0
|
CA
|
A:ILE108
|
4.1
|
23.8
|
1.0
|
CD1
|
A:LEU111
|
4.2
|
29.4
|
1.0
|
CA
|
A:LEU94
|
4.2
|
18.6
|
1.0
|
CB
|
A:ILE108
|
4.3
|
22.8
|
1.0
|
CG1
|
A:ILE108
|
4.4
|
24.2
|
1.0
|
O
|
A:PRO91
|
4.4
|
18.0
|
1.0
|
CB
|
A:LEU95
|
4.4
|
19.1
|
1.0
|
C
|
A:ILE108
|
4.5
|
23.0
|
1.0
|
CD1
|
A:LEU95
|
4.7
|
23.5
|
1.0
|
N
|
A:VAL112
|
4.8
|
19.2
|
1.0
|
CG
|
A:LEU111
|
4.8
|
26.6
|
1.0
|
CG
|
A:LEU94
|
4.9
|
17.2
|
1.0
|
|
Argon binding site 4 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 4 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 4 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar325
b:21.6
occ:0.30
|
C4
|
A:LFA307
|
3.4
|
46.0
|
0.9
|
CB
|
A:ALA114
|
3.6
|
20.4
|
1.0
|
CA
|
A:ALA114
|
3.8
|
19.4
|
1.0
|
CD1
|
A:ILE117
|
3.9
|
24.0
|
1.0
|
O
|
A:HOH487
|
4.0
|
47.5
|
1.0
|
C6
|
A:LFA307
|
4.1
|
23.2
|
0.9
|
CD2
|
A:TYR147
|
4.2
|
30.4
|
1.0
|
C5
|
A:LFA307
|
4.2
|
38.5
|
0.9
|
CB
|
A:ALA144
|
4.2
|
17.9
|
1.0
|
CA
|
A:ALA144
|
4.3
|
17.2
|
1.0
|
CG
|
A:TYR147
|
4.5
|
24.1
|
1.0
|
C3
|
A:LFA307
|
4.6
|
52.9
|
0.9
|
CB
|
A:TYR147
|
4.7
|
19.0
|
1.0
|
CE2
|
A:TYR147
|
4.7
|
37.8
|
1.0
|
O
|
A:ALA114
|
4.8
|
17.1
|
1.0
|
CB
|
A:ILE117
|
4.8
|
19.4
|
1.0
|
C2
|
A:LFA307
|
4.8
|
57.5
|
0.9
|
C
|
A:ALA114
|
4.8
|
16.4
|
1.0
|
N
|
A:ALA114
|
4.8
|
18.1
|
1.0
|
CG2
|
A:ILE117
|
4.9
|
20.7
|
1.0
|
CG1
|
A:ILE117
|
4.9
|
21.3
|
1.0
|
|
Argon binding site 5 out
of 47 in 7q38
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Argon Binding Sites List in 7q38
Argon binding site 5 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 5 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar326
b:21.1
occ:0.31
|
O
|
A:TYR83
|
3.7
|
19.2
|
1.0
|
CG2
|
A:ILE119
|
3.7
|
19.2
|
1.0
|
C8
|
A:LFA303
|
3.8
|
62.5
|
1.0
|
AR
|
A:AR366
|
3.8
|
26.1
|
0.1
|
CD2
|
A:LEU87
|
3.8
|
27.0
|
1.0
|
CD2
|
A:LEU123
|
3.9
|
28.1
|
1.0
|
CB
|
A:LEU87
|
3.9
|
19.4
|
1.0
|
C
|
A:TYR83
|
3.9
|
19.7
|
1.0
|
CB
|
A:TYR83
|
4.1
|
22.4
|
1.0
|
CD1
|
A:LEU87
|
4.1
|
24.9
|
1.0
|
CG
|
A:LEU87
|
4.2
|
23.0
|
1.0
|
C9
|
A:LFA303
|
4.3
|
57.8
|
1.0
|
N
|
A:ALA84
|
4.4
|
19.0
|
1.0
|
CB
|
A:LEU123
|
4.4
|
21.3
|
1.0
|
O
|
A:ILE119
|
4.4
|
19.5
|
1.0
|
CA
|
A:TYR83
|
4.6
|
20.0
|
1.0
|
C
|
A:ILE119
|
4.6
|
19.4
|
1.0
|
C2
|
A:LFA308
|
4.6
|
74.8
|
1.0
|
CA
|
A:GLY120
|
4.6
|
20.0
|
1.0
|
CA
|
A:ALA84
|
4.7
|
21.4
|
1.0
|
N
|
A:GLY120
|
4.7
|
19.0
|
1.0
|
C10
|
A:LFA303
|
4.7
|
48.7
|
1.0
|
CB
|
A:ILE119
|
4.8
|
20.0
|
1.0
|
CG
|
A:LEU123
|
4.8
|
22.3
|
1.0
|
C1
|
A:LFA308
|
4.9
|
70.3
|
1.0
|
CA
|
A:LEU87
|
5.0
|
17.8
|
1.0
|
|
Argon binding site 6 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 6 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 6 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar327
b:19.7
occ:0.39
|
C6
|
A:HEX317
|
3.3
|
50.1
|
1.0
|
CG1
|
A:VAL177
|
3.5
|
25.1
|
1.0
|
O
|
A:SER214
|
3.5
|
18.4
|
1.0
|
C
|
A:GLY218
|
3.6
|
19.2
|
1.0
|
N
|
A:PHE219
|
3.7
|
17.5
|
1.0
|
CA
|
A:GLY218
|
3.7
|
18.3
|
1.0
|
CD1
|
A:ILE222
|
4.0
|
23.0
|
1.0
|
O
|
A:GLY218
|
4.1
|
18.3
|
1.0
|
CG2
|
A:VAL177
|
4.2
|
23.9
|
1.0
|
CD1
|
A:LEU181
|
4.3
|
19.8
|
1.0
|
C
|
A:SER214
|
4.4
|
18.0
|
1.0
|
CB
|
A:VAL177
|
4.4
|
21.8
|
1.0
|
CA
|
A:PHE219
|
4.4
|
19.3
|
1.0
|
C1
|
A:HEX316
|
4.6
|
59.7
|
1.0
|
AR
|
A:AR328
|
4.7
|
20.5
|
0.3
|
C5
|
A:HEX317
|
4.7
|
44.0
|
1.0
|
CA
|
A:SER214
|
4.8
|
17.1
|
1.0
|
CB
|
A:SER214
|
4.9
|
19.4
|
1.0
|
N
|
A:GLY218
|
4.9
|
17.0
|
1.0
|
|
Argon binding site 7 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 7 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 7 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar328
b:20.5
occ:0.34
|
AR
|
A:AR347
|
3.7
|
22.5
|
0.2
|
CG
|
A:LEU181
|
3.7
|
18.4
|
1.0
|
CD2
|
A:LEU181
|
3.9
|
20.7
|
1.0
|
CA
|
A:VAL177
|
4.0
|
18.7
|
1.0
|
AR
|
A:AR363
|
4.1
|
20.1
|
0.2
|
CG1
|
A:VAL180
|
4.1
|
24.4
|
1.0
|
O
|
A:VAL177
|
4.1
|
17.9
|
1.0
|
CD1
|
A:LEU181
|
4.2
|
19.8
|
1.0
|
CB
|
A:VAL180
|
4.2
|
19.5
|
1.0
|
CG2
|
A:VAL177
|
4.2
|
23.9
|
1.0
|
CG1
|
A:VAL177
|
4.3
|
25.1
|
1.0
|
CB
|
A:VAL177
|
4.4
|
21.8
|
1.0
|
C
|
A:VAL177
|
4.6
|
19.2
|
1.0
|
AR
|
A:AR327
|
4.7
|
19.7
|
0.4
|
N
|
A:LEU181
|
4.8
|
17.0
|
1.0
|
CG2
|
A:VAL180
|
4.9
|
20.3
|
1.0
|
|
Argon binding site 8 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 8 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 8 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar329
b:24.9
occ:0.42
|
CG
|
A:LEU109
|
1.8
|
31.1
|
0.6
|
CD2
|
A:LEU109
|
2.1
|
36.2
|
0.6
|
CD1
|
A:LEU109
|
2.7
|
33.3
|
0.6
|
CB
|
A:LEU109
|
3.1
|
25.0
|
0.6
|
N
|
A:ALA110
|
3.5
|
21.3
|
1.0
|
C
|
A:LEU109
|
3.5
|
19.6
|
1.0
|
O
|
A:LEU109
|
3.8
|
20.3
|
1.0
|
CA
|
A:ALA110
|
3.9
|
21.2
|
1.0
|
CA
|
A:LEU109
|
3.9
|
21.4
|
0.6
|
CB
|
A:LEU109
|
4.2
|
26.8
|
0.4
|
CA
|
A:LEU109
|
4.3
|
22.3
|
0.4
|
O
|
A:GLY106
|
4.4
|
21.0
|
1.0
|
CB
|
A:ALA110
|
4.5
|
24.6
|
1.0
|
|
Argon binding site 9 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 9 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 9 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
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A:Ar330
b:22.9
occ:0.23
|
CD1
|
A:LEU25
|
3.3
|
27.4
|
0.5
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CB
|
A:LEU28
|
3.7
|
19.9
|
1.0
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CD1
|
A:LEU28
|
4.0
|
27.1
|
1.0
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CD2
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A:LEU25
|
4.2
|
25.0
|
0.5
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CG2
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A:VAL29
|
4.2
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24.6
|
1.0
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CG
|
A:LEU28
|
4.5
|
23.5
|
1.0
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O
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A:LEU25
|
4.6
|
20.2
|
1.0
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N
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A:VAL29
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4.6
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21.4
|
1.0
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C
|
A:LEU28
|
4.7
|
20.5
|
1.0
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CG
|
A:LEU25
|
4.8
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26.1
|
0.5
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CA
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A:LEU28
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4.9
|
20.0
|
1.0
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CA
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A:LEU25
|
5.0
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21.4
|
0.5
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CA
|
A:LEU25
|
5.0
|
20.5
|
0.5
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Argon binding site 10 out
of 47 in 7q38
Go back to
Argon Binding Sites List in 7q38
Argon binding site 10 out
of 47 in the Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon
Mono view
Stereo pair view
|
A full contact list of Argon with other atoms in the Ar binding
site number 10 of Crystal Structure of the Mutant Bacteriorhodopsin Pressurized with Argon within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ar331
b:27.0
occ:0.40
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OG
|
A:SER59
|
3.4
|
21.0
|
0.5
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AR
|
A:AR344
|
3.7
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21.4
|
0.2
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CB
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A:SER59
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3.7
|
20.0
|
0.5
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N
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A:GLY65
|
3.7
|
30.6
|
1.0
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CE
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A:MET56
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3.8
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24.8
|
0.5
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CB
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A:SER59
|
3.8
|
19.8
|
0.5
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CB
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A:TYR64
|
3.8
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23.4
|
1.0
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CA
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A:GLY65
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3.8
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32.1
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1.0
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CH2
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A:TRP80
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3.9
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39.8
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1.0
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CB
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A:ALA81
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4.0
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25.4
|
1.0
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C
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A:TYR64
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4.2
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30.9
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1.0
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OG
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A:SER59
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4.2
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21.1
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0.5
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CZ2
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A:TRP80
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4.3
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38.2
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1.0
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C5
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A:HEX318
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4.4
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52.8
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1.0
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CZ3
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A:TRP80
|
4.4
|
37.4
|
1.0
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SD
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A:MET56
|
4.6
|
19.9
|
0.5
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AR
|
A:AR356
|
4.6
|
27.6
|
0.2
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CA
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A:TYR64
|
4.7
|
24.2
|
1.0
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CE
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A:MET56
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4.7
|
21.4
|
0.5
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C3
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A:HEX318
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4.7
|
53.8
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1.0
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O
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A:TYR64
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4.8
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32.2
|
1.0
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AR
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A:AR332
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4.9
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23.5
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0.5
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CG
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A:TYR64
|
4.9
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23.6
|
1.0
|
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Reference:
I.Melnikov,
P.Orekhov,
M.Rulev,
K.Kovalev,
R.Astashkin,
D.Bratanov,
Y.Ryzhykau,
T.Balandin,
S.Bukhdruker,
I.Okhrimenko,
V.Borshchevskiy,
G.Bourenkov,
C.Mueller-Dieckmann,
P.Van Der Linden,
P.Carpentier,
G.Leonard,
V.Gordeliy,
A.Popov.
High-Pressure Crystallography Shows Noble Gas Intervention Into Protein-Lipid Interaction and Suggests A Model For Anaesthetic Action. Commun Biol V. 5 360 2022.
ISSN: ESSN 2399-3642
PubMed: 35422073
DOI: 10.1038/S42003-022-03233-Y
Page generated: Wed Jul 10 10:50:51 2024
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