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Sodium in PDB 5ns9: Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate

Protein crystallography data

The structure of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate, PDB code: 5ns9 was solved by C.Eibl, A.J.R.Plested, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.99 / 1.44
Space group P 21 21 2
Cell size a, b, c (Å), α, β, γ (°) 95.990, 121.297, 47.083, 90.00, 90.00, 90.00
R / Rfree (%) 14.7 / 20.5

Sodium Binding Sites:

The binding sites of Sodium atom in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate (pdb code 5ns9). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 5 binding sites of Sodium where determined in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate, PDB code: 5ns9:
Jump to Sodium binding site number: 1; 2; 3; 4; 5;

Sodium binding site 1 out of 5 in 5ns9

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Sodium binding site 1 out of 5 in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na308

b:33.9
occ:1.00
OD1 A:ASP101 2.8 15.0 1.0
HA A:ASP101 3.0 11.4 1.0
HE3 A:LYS226 3.0 29.6 1.0
OE2 A:GLU97 3.0 14.2 1.0
O B:HOH415 3.0 35.9 1.0
O A:GLU97 3.1 12.0 1.0
O A:ILE100 3.1 13.2 1.0
HG3 A:LYS226 3.4 19.9 1.0
O A:HOH558 3.5 50.5 1.0
O A:HOH791 3.5 48.2 1.0
O A:HOH431 3.6 14.4 1.0
C A:ILE100 3.8 11.4 1.0
HG3 A:GLU97 3.8 12.4 1.0
CA A:ASP101 3.8 11.0 1.0
O A:HOH522 3.8 25.8 1.0
CG A:ASP101 3.9 14.3 1.0
CE A:LYS226 3.9 29.8 1.0
CD A:GLU97 4.0 13.1 1.0
N A:ASP101 4.1 10.6 1.0
C A:GLU97 4.2 10.4 1.0
CG A:LYS226 4.2 19.9 1.0
HD2 A:LYS226 4.3 23.7 1.0
HE2 A:LYS226 4.4 29.8 1.0
HA A:GLU97 4.4 11.1 1.0
CB A:ASP101 4.4 12.0 1.0
CG A:GLU97 4.4 12.6 1.0
CD A:LYS226 4.4 23.5 1.0
H A:PHE102 4.6 11.1 1.0
O A:HOH752 4.7 43.3 1.0
HB3 A:ASP101 4.7 11.5 1.0
HG2 A:LYS226 4.7 20.2 1.0
H A:ILE100 4.7 11.9 1.0
HA A:LYS226 4.7 14.3 1.0
CA A:GLU97 4.8 10.9 1.0
O B:HOH642 4.8 19.3 1.0
HZ1 A:LYS226 4.8 27.4 1.0
NZ A:LYS226 4.9 29.5 1.0
CA A:ILE100 4.9 11.0 1.0
H A:ASP101 4.9 11.2 1.0
OE1 A:GLU97 4.9 14.2 1.0
HZ2 A:LYS226 4.9 29.5 1.0
O B:HOH465 4.9 41.8 1.0
N A:ILE100 4.9 11.5 1.0
C A:ASP101 5.0 11.5 1.0
OD1 B:ASN232 5.0 47.9 0.5

Sodium binding site 2 out of 5 in 5ns9

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Sodium binding site 2 out of 5 in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na309

b:34.6
occ:1.00
O B:HOH784 2.4 25.8 1.0
O A:HOH656 2.5 43.4 1.0
HA B:GLN244 2.7 16.3 1.0
O B:GLU243 2.9 14.7 1.0
O A:HOH472 3.1 20.4 1.0
O A:ARG149 3.1 16.2 1.0
HA A:SER150 3.3 13.1 1.0
HB3 A:ARG149 3.4 14.1 1.0
O A:HOH488 3.5 22.9 1.0
C B:GLU243 3.5 14.1 1.0
HG2 B:GLN244 3.5 15.8 1.0
CA B:GLN244 3.6 16.4 1.0
HB2 A:ARG149 3.7 13.9 1.0
C A:ARG149 3.7 15.1 1.0
N B:GLN244 3.8 14.9 1.0
HB3 B:GLU243 3.8 13.3 1.0
CB A:ARG149 3.9 14.0 1.0
CA A:SER150 4.1 13.3 1.0
HG3 B:GLN244 4.1 9.8 1.0
O A:HOH609 4.1 17.6 1.0
H A:LYS151 4.1 14.1 1.0
CG B:GLN244 4.1 16.7 1.0
N A:SER150 4.2 14.1 1.0
O B:HOH510 4.2 18.9 1.0
O B:HOH436 4.3 16.9 1.0
O A:HOH788 4.3 35.8 1.0
CB B:GLN244 4.4 16.7 1.0
CA A:ARG149 4.4 14.4 1.0
HG3 A:LYS151 4.5 21.8 1.0
O A:HOH524 4.5 26.4 1.0
CB B:GLU243 4.6 13.7 1.0
C B:GLN244 4.6 16.1 1.0
CA B:GLU243 4.6 13.5 1.0
H B:GLN244 4.6 14.0 1.0
HB3 B:GLN244 4.7 13.8 1.0
HB2 B:GLU243 4.7 14.2 1.0
N A:LYS151 4.7 14.6 1.0
C A:SER150 4.8 14.3 1.0
HE2 A:LYS151 4.9 38.8 1.0
HA A:ARG149 4.9 13.4 1.0
O B:HOH613 4.9 27.5 1.0
O B:GLN244 4.9 18.5 1.0
H A:SER150 5.0 13.5 1.0
O A:HOH744 5.0 20.5 1.0
HA B:GLU243 5.0 14.3 1.0

Sodium binding site 3 out of 5 in 5ns9

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Sodium binding site 3 out of 5 in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 3 of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na310

b:48.6
occ:1.00
OD2 B:ASP248 2.5 20.5 1.0
O B:HOH772 2.7 44.1 1.0
O B:HOH721 2.7 18.9 1.0
O A:HOH456 2.9 45.2 1.0
O A:LEU215 3.0 16.8 1.0
HE2 A:PHE155 3.5 14.0 1.0
CG B:ASP248 3.6 17.1 1.0
HD12 A:ILE152 3.6 17.6 1.0
HB2 B:ASP248 3.6 16.8 1.0
HA A:ASP216 3.7 14.6 1.0
HA2 B:GLY245 3.7 16.3 1.0
HD13 A:ILE152 3.7 18.0 1.0
HD11 A:ILE152 3.8 18.4 1.0
CD1 A:ILE152 3.9 18.2 1.0
CB B:ASP248 4.0 16.2 1.0
O B:HOH479 4.0 16.5 1.0
HB3 B:ASP248 4.0 16.4 1.0
HB3 A:ASP216 4.0 14.7 1.0
C A:LEU215 4.1 14.1 1.0
HA3 B:GLY245 4.1 14.3 1.0
O B:HOH592 4.3 33.0 1.0
O B:HOH563 4.3 14.4 1.0
HZ A:PHE146 4.3 17.5 1.0
CA B:GLY245 4.4 14.9 1.0
CE2 A:PHE155 4.4 14.7 1.0
HE2 A:PHE146 4.4 15.4 1.0
CA A:ASP216 4.4 14.2 1.0
CB A:ASP216 4.6 14.9 1.0
HB2 A:ASP216 4.6 15.5 1.0
OD1 B:ASP248 4.6 23.2 1.0
N A:ASP216 4.7 14.0 1.0
O B:HOH678 4.8 46.6 1.0
HZ A:PHE155 4.9 15.0 1.0
O B:HOH602 5.0 14.0 1.0
O A:HOH438 5.0 27.7 1.0

Sodium binding site 4 out of 5 in 5ns9

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Sodium binding site 4 out of 5 in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 4 of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na303

b:29.6
occ:1.00
OE1 B:GLU77 2.2 14.9 0.4
HA B:VAL56 2.7 15.1 1.0
OG1 B:THR54 2.8 12.6 0.3
OG1 B:THR9 2.8 14.9 1.0
O B:HOH582 2.8 28.7 1.0
HG1 B:THR54 2.8 13.8 0.0
HG1 B:THR9 3.0 15.8 0.0
HB B:THR9 3.0 13.3 1.0
HA B:THR9 3.1 12.2 1.0
O B:THR54 3.2 20.0 1.0
HG3 B:GLU77 3.2 15.6 0.6
HG21 B:THR54 3.2 19.3 0.7
CD B:GLU77 3.2 14.9 0.4
HB B:THR54 3.3 18.2 0.7
CB B:THR9 3.3 13.2 1.0
HG22 B:THR54 3.4 18.3 0.7
CA B:VAL56 3.5 14.9 1.0
N B:VAL56 3.5 13.7 1.0
OE2 B:GLU77 3.6 14.1 0.4
CG2 B:THR54 3.6 18.8 0.7
CA B:THR9 3.7 12.5 1.0
O B:ILE55 3.7 13.4 1.0
C B:ILE55 3.8 12.6 1.0
HB B:THR54 3.8 14.0 0.3
C B:THR54 3.8 13.5 1.0
CB B:THR54 3.8 14.4 0.3
CB B:THR54 3.8 17.3 0.7
H B:VAL56 3.9 13.3 1.0
H B:THR10 3.9 11.1 1.0
HB B:VAL56 4.0 14.7 1.0
H B:GLY57 4.0 16.3 1.0
CG B:GLU77 4.1 15.5 0.6
OE1 B:GLU77 4.1 18.4 0.6
HG23 B:VAL56 4.1 16.5 1.0
HB1 B:ALA83 4.2 17.4 1.0
CB B:VAL56 4.3 15.2 1.0
O B:HOH656 4.4 40.7 1.0
HB3 B:GLU77 4.4 12.2 0.4
HB3 B:GLU77 4.4 12.3 0.6
CA B:THR54 4.5 15.2 0.7
N B:ILE55 4.5 13.7 1.0
CD B:GLU77 4.5 16.4 0.6
CA B:THR54 4.5 14.9 0.3
CG B:GLU77 4.5 13.4 0.4
HG23 B:THR54 4.5 18.6 0.7
C B:VAL56 4.5 14.7 1.0
N B:GLY57 4.6 15.6 1.0
CA B:ILE55 4.6 11.8 1.0
N B:THR10 4.6 11.1 1.0
HB2 B:GLU77 4.6 11.4 0.4
N B:THR9 4.7 10.7 1.0
C B:THR9 4.7 12.2 1.0
HG2 B:GLU77 4.7 15.2 0.6
CG2 B:THR9 4.7 13.1 1.0
CG2 B:VAL56 4.7 16.7 1.0
HA B:ILE55 4.7 11.4 1.0
CB B:GLU77 4.8 11.8 0.6
CB B:GLU77 4.8 12.2 0.4
HG22 B:THR9 4.8 12.7 1.0
HB2 B:GLU77 4.9 10.9 0.6
O B:VAL8 4.9 15.1 1.0
HG22 B:THR54 5.0 14.3 0.3

Sodium binding site 5 out of 5 in 5ns9

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Sodium binding site 5 out of 5 in the Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 5 of Crystal Structure of the GLUA2 Lbd (L483Y-N754S-L758V) in Complex with Glutamate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na304

b:48.9
occ:1.00
O B:HOH416 2.4 29.2 1.0
O B:GLY213 2.5 24.8 1.0
O B:VAL211 2.9 19.4 1.0
HG13 B:ILE113 2.9 16.4 1.0
HD11 B:LEU215 3.0 20.6 0.5
H B:ILE113 3.1 11.6 1.0
HD12 B:LEU215 3.1 20.2 0.5
O B:HOH591 3.2 29.7 1.0
HA3 B:GLY212 3.2 22.6 1.0
HA B:SER112 3.3 11.8 1.0
HD11 B:ILE113 3.3 17.0 1.0
HD12 B:ILE113 3.4 16.7 1.0
CD1 B:LEU215 3.4 20.2 0.5
HD13 B:LEU215 3.5 20.7 0.5
CG1 B:ILE113 3.5 16.8 1.0
HB B:ILE113 3.5 14.0 1.0
CD1 B:ILE113 3.6 16.8 1.0
C B:GLY212 3.6 24.2 1.0
HD22 B:LEU215 3.6 17.2 0.6
C B:GLY213 3.7 21.6 1.0
N B:ILE113 3.7 11.2 1.0
HD23 B:LEU215 3.7 16.1 0.6
N B:GLY213 3.8 24.9 1.0
CA B:GLY212 3.8 22.7 1.0
HG B:LEU215 3.9 18.8 0.6
C B:VAL211 3.9 17.9 1.0
CB B:ILE113 4.0 13.9 1.0
H B:GLY213 4.0 25.3 1.0
O B:GLY212 4.0 21.2 1.0
CD2 B:LEU215 4.1 16.4 0.6
CA B:SER112 4.1 11.7 1.0
HA B:ASN214 4.2 16.1 1.0
HA B:SER123 4.2 18.2 1.0
C B:SER112 4.3 12.3 1.0
HZ1 B:LYS210 4.3 31.1 1.0
HB2 B:SER112 4.3 13.4 1.0
N B:GLY212 4.4 21.1 1.0
HG12 B:ILE113 4.4 16.8 1.0
H B:ALA124 4.4 17.7 1.0
CA B:GLY213 4.4 25.7 1.0
CA B:ILE113 4.5 13.1 1.0
HD13 B:ILE113 4.5 16.5 1.0
CG B:LEU215 4.5 18.9 0.6
HA2 B:GLY212 4.6 22.5 1.0
HD12 B:LEU215 4.7 22.4 0.6
N B:ASN214 4.7 16.0 1.0
HZ3 B:LYS210 4.7 32.2 1.0
HG23 B:VAL211 4.7 21.8 1.0
CB B:SER112 4.8 13.7 1.0
CA B:ASN214 4.8 17.6 1.0
CG B:LEU215 4.9 20.0 0.5
HB1 B:ALA124 4.9 19.5 1.0
NZ B:LYS210 4.9 31.8 1.0
HD21 B:LEU215 4.9 16.7 0.6
H B:LEU215 4.9 17.1 1.0
O B:ILE111 5.0 16.3 1.0
N B:ALA124 5.0 19.2 1.0

Reference:

W.Zhang, C.Eibl, A.M.Weeks, I.Riva, Y.J.Li, A.J.R.Plested, J.R.Howe. Unitary Properties of Ampa Receptors with Reduced Desensitization. Biophys. J. V. 113 2218 2017.
ISSN: ESSN 1542-0086
PubMed: 28863863
DOI: 10.1016/J.BPJ.2017.07.030
Page generated: Mon Oct 7 23:02:55 2024

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