Magnesium in PDB 1vg8: Gppnhp-Bound RAB7
Protein crystallography data
The structure of Gppnhp-Bound RAB7, PDB code: 1vg8
was solved by
A.Rak,
O.Pylypenko,
A.Niculae,
K.Pyatkov,
R.S.Goody,
K.Alexandrov,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.56 /
1.70
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
57.058,
57.071,
74.310,
71.73,
71.69,
77.65
|
R / Rfree (%)
|
19.8 /
22.4
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Gppnhp-Bound RAB7
(pdb code 1vg8). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Gppnhp-Bound RAB7, PDB code: 1vg8:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 1vg8
Go back to
Magnesium Binding Sites List in 1vg8
Magnesium binding site 1 out
of 4 in the Gppnhp-Bound RAB7
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Gppnhp-Bound RAB7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg1401
b:16.2
occ:1.00
|
O2B
|
A:GNP1400
|
2.0
|
13.9
|
1.0
|
O2G
|
A:GNP1400
|
2.0
|
17.3
|
1.0
|
OG1
|
A:THR1040
|
2.1
|
17.3
|
1.0
|
OG1
|
A:THR1022
|
2.1
|
15.1
|
1.0
|
O
|
A:HOH5314
|
2.1
|
19.6
|
1.0
|
O
|
A:HOH5002
|
2.2
|
14.2
|
1.0
|
CB
|
A:THR1040
|
3.1
|
18.5
|
1.0
|
CB
|
A:THR1022
|
3.2
|
16.4
|
1.0
|
PG
|
A:GNP1400
|
3.2
|
18.1
|
1.0
|
PB
|
A:GNP1400
|
3.3
|
15.1
|
1.0
|
N3B
|
A:GNP1400
|
3.5
|
15.1
|
1.0
|
N
|
A:THR1022
|
3.9
|
14.6
|
1.0
|
O3G
|
A:GNP1400
|
3.9
|
17.5
|
1.0
|
N
|
A:THR1040
|
3.9
|
20.8
|
1.0
|
OD1
|
A:ASP1063
|
4.0
|
17.4
|
1.0
|
O2A
|
A:GNP1400
|
4.0
|
16.8
|
1.0
|
CA
|
A:THR1022
|
4.1
|
15.5
|
1.0
|
CA
|
A:THR1040
|
4.1
|
20.0
|
1.0
|
OD2
|
A:ASP1063
|
4.1
|
17.3
|
1.0
|
CG2
|
A:THR1022
|
4.2
|
17.3
|
1.0
|
CG2
|
A:THR1040
|
4.2
|
17.9
|
1.0
|
O1B
|
A:GNP1400
|
4.3
|
14.9
|
1.0
|
O3A
|
A:GNP1400
|
4.3
|
16.3
|
1.0
|
O
|
A:HOH5087
|
4.3
|
23.1
|
1.0
|
O1G
|
A:GNP1400
|
4.4
|
20.7
|
1.0
|
CG
|
A:ASP1063
|
4.4
|
17.8
|
1.0
|
O
|
A:LYS1038
|
4.5
|
23.8
|
1.0
|
O
|
A:THR1064
|
4.5
|
19.2
|
1.0
|
PA
|
A:GNP1400
|
4.6
|
17.9
|
1.0
|
O1A
|
A:GNP1400
|
4.8
|
15.4
|
1.0
|
CB
|
A:LYS1021
|
4.8
|
12.8
|
1.0
|
C
|
A:ALA1039
|
4.9
|
21.7
|
1.0
|
CE
|
A:LYS1021
|
5.0
|
17.1
|
1.0
|
C
|
A:LYS1021
|
5.0
|
15.9
|
1.0
|
NZ
|
A:LYS1021
|
5.0
|
16.5
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 1vg8
Go back to
Magnesium Binding Sites List in 1vg8
Magnesium binding site 2 out
of 4 in the Gppnhp-Bound RAB7
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Gppnhp-Bound RAB7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg2401
b:15.9
occ:1.00
|
O2G
|
B:GNP2400
|
2.0
|
14.3
|
1.0
|
OG1
|
B:THR2022
|
2.0
|
13.3
|
1.0
|
O
|
B:HOH5006
|
2.1
|
14.4
|
1.0
|
O2B
|
B:GNP2400
|
2.1
|
13.2
|
1.0
|
OG1
|
B:THR2040
|
2.1
|
16.1
|
1.0
|
O
|
B:HOH5315
|
2.1
|
17.9
|
1.0
|
CB
|
B:THR2040
|
3.1
|
18.0
|
1.0
|
CB
|
B:THR2022
|
3.1
|
17.9
|
1.0
|
PG
|
B:GNP2400
|
3.2
|
18.7
|
1.0
|
PB
|
B:GNP2400
|
3.3
|
14.9
|
1.0
|
N3B
|
B:GNP2400
|
3.5
|
14.9
|
1.0
|
N
|
B:THR2040
|
3.8
|
19.4
|
1.0
|
N
|
B:THR2022
|
3.9
|
14.5
|
1.0
|
O3G
|
B:GNP2400
|
3.9
|
17.2
|
1.0
|
OD2
|
B:ASP2063
|
4.0
|
21.4
|
1.0
|
CA
|
B:THR2040
|
4.0
|
19.9
|
1.0
|
CA
|
B:THR2022
|
4.1
|
15.5
|
1.0
|
O2A
|
B:GNP2400
|
4.1
|
19.4
|
1.0
|
OD1
|
B:ASP2063
|
4.1
|
17.9
|
1.0
|
CG2
|
B:THR2040
|
4.2
|
18.3
|
1.0
|
CG2
|
B:THR2022
|
4.2
|
18.3
|
1.0
|
O
|
B:HOH5063
|
4.3
|
24.4
|
1.0
|
O3A
|
B:GNP2400
|
4.3
|
15.7
|
1.0
|
O1B
|
B:GNP2400
|
4.3
|
15.1
|
1.0
|
CG
|
B:ASP2063
|
4.4
|
21.5
|
1.0
|
O1G
|
B:GNP2400
|
4.5
|
18.7
|
1.0
|
O
|
B:THR2064
|
4.5
|
17.5
|
1.0
|
PA
|
B:GNP2400
|
4.6
|
16.4
|
1.0
|
O
|
B:LYS2038
|
4.6
|
23.2
|
1.0
|
O1A
|
B:GNP2400
|
4.8
|
16.4
|
1.0
|
C
|
B:ALA2039
|
4.8
|
22.2
|
1.0
|
CB
|
B:LYS2021
|
4.9
|
15.0
|
1.0
|
C
|
B:LYS2021
|
5.0
|
16.0
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 1vg8
Go back to
Magnesium Binding Sites List in 1vg8
Magnesium binding site 3 out
of 4 in the Gppnhp-Bound RAB7
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Gppnhp-Bound RAB7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg3401
b:16.5
occ:1.00
|
O2G
|
C:GNP3400
|
2.0
|
14.7
|
1.0
|
O2B
|
C:GNP3400
|
2.0
|
13.4
|
1.0
|
OG1
|
C:THR3022
|
2.1
|
13.3
|
1.0
|
O
|
C:HOH5001
|
2.1
|
14.6
|
1.0
|
O
|
C:HOH5009
|
2.2
|
17.2
|
1.0
|
OG1
|
C:THR3040
|
2.2
|
15.5
|
1.0
|
CB
|
C:THR3040
|
3.1
|
17.8
|
1.0
|
CB
|
C:THR3022
|
3.1
|
18.5
|
1.0
|
PG
|
C:GNP3400
|
3.2
|
19.2
|
1.0
|
PB
|
C:GNP3400
|
3.3
|
15.4
|
1.0
|
N3B
|
C:GNP3400
|
3.5
|
15.6
|
1.0
|
N
|
C:THR3040
|
3.9
|
19.6
|
1.0
|
N
|
C:THR3022
|
3.9
|
15.2
|
1.0
|
O3G
|
C:GNP3400
|
3.9
|
17.5
|
1.0
|
OD2
|
C:ASP3063
|
4.0
|
19.5
|
1.0
|
CA
|
C:THR3040
|
4.1
|
19.4
|
1.0
|
OD1
|
C:ASP3063
|
4.1
|
18.8
|
1.0
|
O2A
|
C:GNP3400
|
4.1
|
18.8
|
1.0
|
CA
|
C:THR3022
|
4.1
|
16.2
|
1.0
|
CG2
|
C:THR3022
|
4.2
|
16.4
|
1.0
|
CG2
|
C:THR3040
|
4.2
|
18.8
|
1.0
|
O3A
|
C:GNP3400
|
4.3
|
15.7
|
1.0
|
O1B
|
C:GNP3400
|
4.3
|
14.6
|
1.0
|
O
|
C:HOH5072
|
4.3
|
28.0
|
1.0
|
CG
|
C:ASP3063
|
4.4
|
20.1
|
1.0
|
O1G
|
C:GNP3400
|
4.4
|
19.7
|
1.0
|
O
|
C:THR3064
|
4.5
|
16.9
|
1.0
|
PA
|
C:GNP3400
|
4.5
|
16.1
|
1.0
|
O
|
C:LYS3038
|
4.5
|
22.8
|
1.0
|
O1A
|
C:GNP3400
|
4.7
|
16.2
|
1.0
|
CB
|
C:LYS3021
|
4.8
|
15.0
|
1.0
|
C
|
C:ALA3039
|
4.9
|
21.6
|
1.0
|
NZ
|
C:LYS3021
|
5.0
|
14.5
|
1.0
|
C
|
C:LYS3021
|
5.0
|
17.6
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 1vg8
Go back to
Magnesium Binding Sites List in 1vg8
Magnesium binding site 4 out
of 4 in the Gppnhp-Bound RAB7
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Gppnhp-Bound RAB7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg4401
b:15.7
occ:1.00
|
O2B
|
D:GNP4400
|
2.0
|
13.9
|
1.0
|
O2G
|
D:GNP4400
|
2.0
|
16.8
|
1.0
|
OG1
|
D:THR4022
|
2.0
|
16.0
|
1.0
|
OG1
|
D:THR4040
|
2.1
|
16.2
|
1.0
|
O
|
D:HOH5316
|
2.1
|
13.8
|
1.0
|
O
|
D:HOH5003
|
2.1
|
18.7
|
1.0
|
CB
|
D:THR4040
|
3.1
|
19.2
|
1.0
|
PG
|
D:GNP4400
|
3.2
|
18.5
|
1.0
|
CB
|
D:THR4022
|
3.2
|
17.8
|
1.0
|
PB
|
D:GNP4400
|
3.3
|
14.6
|
1.0
|
N3B
|
D:GNP4400
|
3.5
|
14.8
|
1.0
|
O3G
|
D:GNP4400
|
3.8
|
17.6
|
1.0
|
N
|
D:THR4040
|
3.9
|
20.2
|
1.0
|
N
|
D:THR4022
|
3.9
|
14.1
|
1.0
|
OD1
|
D:ASP4063
|
4.0
|
19.1
|
1.0
|
CA
|
D:THR4040
|
4.1
|
19.7
|
1.0
|
O2A
|
D:GNP4400
|
4.1
|
17.9
|
1.0
|
CA
|
D:THR4022
|
4.1
|
15.9
|
1.0
|
OD2
|
D:ASP4063
|
4.1
|
17.6
|
1.0
|
CG2
|
D:THR4022
|
4.2
|
17.0
|
1.0
|
CG2
|
D:THR4040
|
4.2
|
21.0
|
1.0
|
O1B
|
D:GNP4400
|
4.3
|
14.2
|
1.0
|
O3A
|
D:GNP4400
|
4.3
|
15.7
|
1.0
|
O1G
|
D:GNP4400
|
4.4
|
22.3
|
1.0
|
O
|
D:HOH5059
|
4.4
|
25.4
|
1.0
|
CG
|
D:ASP4063
|
4.5
|
18.8
|
1.0
|
O
|
D:THR4064
|
4.5
|
19.3
|
1.0
|
O
|
D:LYS4038
|
4.6
|
23.2
|
1.0
|
PA
|
D:GNP4400
|
4.6
|
17.7
|
1.0
|
O1A
|
D:GNP4400
|
4.8
|
15.5
|
1.0
|
C
|
D:ALA4039
|
4.9
|
21.7
|
1.0
|
CB
|
D:LYS4021
|
4.9
|
14.2
|
1.0
|
NZ
|
D:LYS4021
|
5.0
|
16.6
|
1.0
|
CE
|
D:LYS4021
|
5.0
|
16.6
|
1.0
|
|
Reference:
A.Rak,
O.Pylypenko,
A.Niculae,
K.Pyatkov,
R.S.Goody,
K.Alexandrov.
Structure of the RAB7:Rep-1 Complex: Insights Into the Mechanism of Rab Prenylation and Choroideremia Disease Cell(Cambridge,Mass.) V. 117 749 2004.
ISSN: ISSN 0092-8674
PubMed: 15186776
DOI: 10.1016/J.CELL.2004.05.017
Page generated: Tue Aug 13 15:04:36 2024
|