Magnesium in PDB 8dzm: Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
Protein crystallography data
The structure of Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium, PDB code: 8dzm
was solved by
Q.Huang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.42 /
1.65
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
136.125,
35.933,
76.118,
90,
101.52,
90
|
R / Rfree (%)
|
17 /
19.7
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
(pdb code 8dzm). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium, PDB code: 8dzm:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 8dzm
Go back to
Magnesium Binding Sites List in 8dzm
Magnesium binding site 1 out
of 4 in the Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg201
b:16.1
occ:1.00
|
O2D
|
A:G4P203
|
2.0
|
17.0
|
1.0
|
O
|
A:HOH328
|
2.1
|
16.4
|
1.0
|
O2C
|
A:G4P203
|
2.1
|
17.1
|
1.0
|
PD
|
A:G4P203
|
3.2
|
18.2
|
1.0
|
PC
|
A:G4P203
|
3.2
|
17.0
|
1.0
|
O3C
|
A:G4P203
|
3.3
|
18.2
|
1.0
|
O1D
|
A:G4P203
|
4.2
|
18.9
|
1.0
|
O
|
A:HOH413
|
4.2
|
29.4
|
1.0
|
O2A
|
A:G4P203
|
4.2
|
16.8
|
1.0
|
O3D
|
A:G4P203
|
4.3
|
20.6
|
1.0
|
O3'
|
A:G4P203
|
4.3
|
16.8
|
1.0
|
C3'
|
A:G4P203
|
4.3
|
16.5
|
1.0
|
O
|
A:HOH367
|
4.3
|
19.9
|
1.0
|
O1C
|
A:G4P203
|
4.3
|
18.5
|
1.0
|
C5'
|
A:G4P203
|
4.5
|
15.5
|
1.0
|
O
|
A:HOH355
|
4.6
|
20.0
|
1.0
|
C4'
|
A:G4P203
|
4.6
|
16.3
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 8dzm
Go back to
Magnesium Binding Sites List in 8dzm
Magnesium binding site 2 out
of 4 in the Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg202
b:17.9
occ:1.00
|
O
|
A:HOH378
|
2.0
|
18.3
|
1.0
|
O1B
|
A:G4P203
|
2.0
|
16.2
|
1.0
|
OG1
|
A:THR39
|
2.0
|
17.3
|
1.0
|
O
|
A:HOH322
|
2.1
|
19.9
|
1.0
|
O
|
A:HOH391
|
2.1
|
19.3
|
1.0
|
O
|
A:HOH316
|
2.2
|
16.2
|
1.0
|
CB
|
A:THR39
|
3.1
|
18.1
|
1.0
|
PB
|
A:G4P203
|
3.3
|
14.6
|
1.0
|
O2B
|
A:G4P203
|
3.5
|
15.9
|
1.0
|
N
|
A:THR39
|
4.0
|
14.3
|
1.0
|
O2A
|
A:G4P203
|
4.0
|
16.8
|
1.0
|
OD1
|
A:ASP75
|
4.1
|
21.3
|
1.0
|
CG2
|
A:THR39
|
4.1
|
19.3
|
1.0
|
CA
|
A:THR39
|
4.1
|
14.5
|
1.0
|
O
|
A:HOH320
|
4.1
|
22.3
|
1.0
|
O
|
A:HOH443
|
4.2
|
49.8
|
1.0
|
OD2
|
A:ASP75
|
4.3
|
24.1
|
1.0
|
O
|
A:HOH310
|
4.3
|
45.6
|
1.0
|
O3A
|
A:G4P203
|
4.3
|
15.3
|
1.0
|
O
|
A:HOH359
|
4.3
|
22.8
|
1.0
|
O3B
|
A:G4P203
|
4.3
|
16.2
|
1.0
|
CG
|
A:LYS38
|
4.4
|
18.5
|
1.0
|
PA
|
A:G4P203
|
4.6
|
15.8
|
1.0
|
CG
|
A:ASP75
|
4.6
|
19.8
|
1.0
|
O1A
|
A:G4P203
|
4.7
|
17.1
|
1.0
|
O
|
A:HOH355
|
4.8
|
20.0
|
1.0
|
O
|
A:HOH338
|
4.9
|
65.1
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 8dzm
Go back to
Magnesium Binding Sites List in 8dzm
Magnesium binding site 3 out
of 4 in the Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg201
b:17.8
occ:1.00
|
O2B
|
B:G4P203
|
2.0
|
14.9
|
1.0
|
O
|
B:HOH333
|
2.0
|
18.2
|
1.0
|
OG1
|
B:THR39
|
2.1
|
20.6
|
1.0
|
O
|
B:HOH350
|
2.1
|
20.6
|
1.0
|
O
|
B:HOH386
|
2.1
|
19.9
|
1.0
|
O
|
B:HOH321
|
2.1
|
19.0
|
1.0
|
CB
|
B:THR39
|
3.2
|
20.1
|
1.0
|
PB
|
B:G4P203
|
3.3
|
16.4
|
1.0
|
O1B
|
B:G4P203
|
3.4
|
16.6
|
1.0
|
N
|
B:THR39
|
4.0
|
13.8
|
1.0
|
O2A
|
B:G4P203
|
4.0
|
15.8
|
1.0
|
OD1
|
B:ASP75
|
4.0
|
23.9
|
1.0
|
CG2
|
B:THR39
|
4.1
|
23.1
|
1.0
|
CA
|
B:THR39
|
4.2
|
16.9
|
1.0
|
O
|
B:HOH339
|
4.2
|
27.1
|
1.0
|
OD2
|
B:ASP75
|
4.2
|
26.2
|
1.0
|
O3B
|
B:G4P203
|
4.3
|
16.5
|
1.0
|
O3A
|
B:G4P203
|
4.3
|
13.8
|
1.0
|
CG
|
B:LYS38
|
4.4
|
18.9
|
1.0
|
O
|
B:HOH301
|
4.4
|
28.1
|
1.0
|
PA
|
B:G4P203
|
4.6
|
15.6
|
1.0
|
CG
|
B:ASP75
|
4.6
|
23.5
|
1.0
|
O1A
|
B:G4P203
|
4.7
|
17.6
|
1.0
|
O
|
B:HOH354
|
4.7
|
17.5
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 8dzm
Go back to
Magnesium Binding Sites List in 8dzm
Magnesium binding site 4 out
of 4 in the Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Crystal Structure of Human SAR1A in Complex with Ppgpp and Magnesium within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg202
b:15.6
occ:1.00
|
O1D
|
B:G4P203
|
2.0
|
15.2
|
1.0
|
O
|
B:HOH328
|
2.1
|
15.1
|
1.0
|
O1C
|
B:G4P203
|
2.1
|
14.8
|
1.0
|
PD
|
B:G4P203
|
3.2
|
18.2
|
1.0
|
PC
|
B:G4P203
|
3.3
|
17.1
|
1.0
|
O3C
|
B:G4P203
|
3.3
|
17.5
|
1.0
|
O2D
|
B:G4P203
|
4.1
|
20.3
|
1.0
|
O
|
B:HOH402
|
4.2
|
28.5
|
1.0
|
O2A
|
B:G4P203
|
4.3
|
15.8
|
1.0
|
C3'
|
B:G4P203
|
4.3
|
15.2
|
1.0
|
O3'
|
B:G4P203
|
4.3
|
17.4
|
1.0
|
O3D
|
B:G4P203
|
4.3
|
20.6
|
1.0
|
O2C
|
B:G4P203
|
4.3
|
19.2
|
1.0
|
O
|
B:HOH358
|
4.3
|
20.6
|
1.0
|
C5'
|
B:G4P203
|
4.5
|
19.2
|
1.0
|
O
|
B:HOH354
|
4.6
|
17.5
|
1.0
|
C4'
|
B:G4P203
|
4.7
|
17.4
|
1.0
|
|
Reference:
Q.Huang,
Q.Huang.
N/A N/A.
Page generated: Fri Oct 4 00:58:57 2024
|