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Sodium in PDB 6c1k: Hypopp Mutant with LIGAND1

Protein crystallography data

The structure of Hypopp Mutant with LIGAND1, PDB code: 6c1k was solved by W.A.Catterall, N.Zheng, D.Jiang, T.M.Gamal El-Din, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 42.31 / 2.70
Space group I 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 126.394, 126.235, 191.525, 90.00, 90.00, 90.00
R / Rfree (%) 21 / 24.6

Sodium Binding Sites:

The binding sites of Sodium atom in the Hypopp Mutant with LIGAND1 (pdb code 6c1k). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 4 binding sites of Sodium where determined in the Hypopp Mutant with LIGAND1, PDB code: 6c1k:
Jump to Sodium binding site number: 1; 2; 3; 4;

Sodium binding site 1 out of 4 in 6c1k

Go back to Sodium Binding Sites List in 6c1k
Sodium binding site 1 out of 4 in the Hypopp Mutant with LIGAND1


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Hypopp Mutant with LIGAND1 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na1311

b:82.6
occ:1.00
O A:GLY1182 3.2 60.2 1.0
CE B:MET2181 3.7 28.4 1.0
CZ2 A:TRP1159 3.7 51.2 1.0
CH2 A:TRP1159 4.0 50.0 1.0
C A:GLY1182 4.0 52.7 1.0
CA A:GLY1182 4.0 40.7 1.0
CG A:PRO1186 4.4 37.9 1.0
O A:MET1181 4.9 64.0 1.0
CE2 A:TRP1159 4.9 49.7 1.0

Sodium binding site 2 out of 4 in 6c1k

Go back to Sodium Binding Sites List in 6c1k
Sodium binding site 2 out of 4 in the Hypopp Mutant with LIGAND1


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Hypopp Mutant with LIGAND1 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na1312

b:88.3
occ:1.00
OE2 A:GLU1158 2.6 83.6 1.0
NE1 A:TRP1159 2.7 51.8 1.0
CD A:GLU1158 3.5 76.1 1.0
CE B:MET2181 3.5 28.4 1.0
CE2 A:TRP1159 3.6 49.7 1.0
CD1 A:TRP1159 3.7 51.7 1.0
CD B:ARG2185 3.7 44.6 1.0
CZ2 A:TRP1159 3.9 51.2 1.0
OE1 A:GLU1158 4.0 75.7 1.0
SD B:MET2181 4.1 48.3 1.0
NE B:ARG2185 4.2 47.4 1.0
CG A:GLU1158 4.6 62.6 1.0
CZ B:ARG2185 4.7 46.0 1.0
CG B:ARG2185 4.8 44.8 1.0
CD2 A:TRP1159 4.8 60.7 1.0
CG A:TRP1159 4.9 48.2 1.0
NH1 B:ARG2185 4.9 45.8 1.0
CB B:ARG2185 5.0 29.9 1.0

Sodium binding site 3 out of 4 in 6c1k

Go back to Sodium Binding Sites List in 6c1k
Sodium binding site 3 out of 4 in the Hypopp Mutant with LIGAND1


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 3 of Hypopp Mutant with LIGAND1 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na2310

b:76.3
occ:1.00
O B:GLY2182 3.1 61.7 1.0
CZ2 B:TRP2159 3.6 51.1 1.0
CH2 B:TRP2159 3.9 50.9 1.0
C B:GLY2182 3.9 56.2 1.0
CA B:GLY2182 3.9 42.2 1.0
CG B:PRO2186 4.3 36.3 1.0
O B:MET2181 4.7 66.0 1.0
CE2 B:TRP2159 4.9 54.5 1.0

Sodium binding site 4 out of 4 in 6c1k

Go back to Sodium Binding Sites List in 6c1k
Sodium binding site 4 out of 4 in the Hypopp Mutant with LIGAND1


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 4 of Hypopp Mutant with LIGAND1 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na2311

b:86.8
occ:1.00
NE1 B:TRP2159 2.6 50.0 1.0
OE2 B:GLU2158 2.7 80.0 1.0
CD B:GLU2158 3.4 81.7 1.0
CE2 B:TRP2159 3.6 54.5 1.0
CD1 B:TRP2159 3.6 48.5 1.0
OE1 B:GLU2158 3.8 92.5 1.0
CZ2 B:TRP2159 3.9 51.1 1.0
CG B:GLU2158 4.6 74.4 1.0
O B:HOH2403 4.8 47.6 1.0
CD2 B:TRP2159 4.8 54.2 1.0
CG B:TRP2159 4.8 47.2 1.0

Reference:

D.Jiang, T.M.Gamal El-Din, C.Ing, P.Lu, R.Pomes, N.Zheng, W.A.Catterall. Structural Basis For Gating Pore Current in Periodic Paralysis. Nature V. 557 590 2018.
ISSN: ESSN 1476-4687
PubMed: 29769724
DOI: 10.1038/S41586-018-0120-4
Page generated: Tue Oct 8 06:30:06 2024

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