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Potassium in PDB 6xph: Cutr Dimer with Domain Swap

Protein crystallography data

The structure of Cutr Dimer with Domain Swap, PDB code: 6xph was solved by J.M.Ochoa, M.R.Sawaya, V.N.Nguyen, C.Duilio, T.O.Yeates, M.Nie, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 77.54 / 1.80
Space group P 43 3 2
Cell size a, b, c (Å), α, β, γ (°) 110.290, 110.290, 110.290, 90.00, 90.00, 90.00
R / Rfree (%) 17.6 / 21

Other elements in 6xph:

The structure of Cutr Dimer with Domain Swap also contains other interesting chemical elements:

Sodium (Na) 1 atom

Potassium Binding Sites:

The binding sites of Potassium atom in the Cutr Dimer with Domain Swap (pdb code 6xph). This binding sites where shown within 5.0 Angstroms radius around Potassium atom.
In total 2 binding sites of Potassium where determined in the Cutr Dimer with Domain Swap, PDB code: 6xph:
Jump to Potassium binding site number: 1; 2;

Potassium binding site 1 out of 2 in 6xph

Go back to Potassium Binding Sites List in 6xph
Potassium binding site 1 out of 2 in the Cutr Dimer with Domain Swap


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 1 of Cutr Dimer with Domain Swap within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K201

b:51.9
occ:1.00
O A:HOH344 2.5 49.7 1.0
O A:HOH349 2.5 43.8 1.0
O A:ALA67 2.5 39.6 1.0
O A:GLY65 2.5 41.2 1.0
O A:ILE70 2.5 35.8 1.0
O A:HOH331 2.9 49.8 1.0
C A:GLY65 3.6 38.4 1.0
C A:ILE70 3.7 35.9 1.0
C A:ALA67 3.7 37.7 1.0
N A:ILE70 4.0 34.9 1.0
O A:ALA68 4.2 51.0 1.0
N A:ALA67 4.2 37.4 1.0
CA A:GLY65 4.3 35.4 1.0
CA A:ILE70 4.3 33.5 1.0
C A:ALA68 4.3 47.9 1.0
C A:ASP66 4.4 41.2 1.0
N A:ASP66 4.5 38.3 1.0
CA A:ALA68 4.5 43.7 1.0
OD1 A:ASP71 4.6 63.0 1.0
N A:ALA68 4.6 43.6 1.0
CB A:ILE70 4.6 33.8 1.0
CA A:ALA67 4.6 42.5 1.0
CA A:ASP66 4.7 41.4 1.0
O A:ASP66 4.7 43.4 1.0
N A:ASP71 4.8 34.5 1.0
O A:ALA64 4.8 35.6 1.0
N A:ASN69 4.9 41.6 1.0
O A:HOH339 4.9 34.4 1.0

Potassium binding site 2 out of 2 in 6xph

Go back to Potassium Binding Sites List in 6xph
Potassium binding site 2 out of 2 in the Cutr Dimer with Domain Swap


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 2 of Cutr Dimer with Domain Swap within 5.0Å range:
probe atom residue distance (Å) B Occ
B:K201

b:50.0
occ:1.00
O B:ILE70 2.4 34.8 1.0
O B:ALA67 2.5 38.5 1.0
O B:HOH358 2.5 43.3 1.0
O B:HOH355 2.5 47.1 1.0
O B:GLY65 2.6 32.3 1.0
C B:ILE70 3.6 36.2 1.0
C B:ALA67 3.6 40.6 1.0
C B:GLY65 3.7 33.6 1.0
O B:ALA68 3.9 48.9 1.0
N B:ILE70 4.0 33.2 1.0
C B:ALA68 4.1 45.7 1.0
CA B:ILE70 4.3 31.3 1.0
CA B:ALA68 4.3 48.9 1.0
N B:ALA67 4.3 34.4 1.0
CA B:GLY65 4.4 32.5 1.0
N B:ALA68 4.4 47.1 1.0
C B:ASP66 4.4 40.1 1.0
CB B:ILE70 4.6 32.2 1.0
CA B:ALA67 4.6 36.5 1.0
N B:ASP71 4.7 31.6 1.0
N B:ASP66 4.7 33.1 1.0
OD1 B:ASP71 4.7 59.7 1.0
O B:ASP66 4.8 41.0 1.0
N B:ASN69 4.8 39.2 1.0
CA B:ASP66 4.9 36.0 1.0
O B:HOH345 4.9 36.4 1.0
O B:ALA64 4.9 33.1 1.0

Reference:

J.M.Ochoa, V.N.Nguyen, M.Nie, M.R.Sawaya, T.A.Bobik, T.O.Yeates. Symmetry Breaking and Structural Polymorphism in A Bacterial Microcompartment Shell Protein For Choline Utilization. Protein Sci. V. 29 2201 2020.
ISSN: ESSN 1469-896X
PubMed: 32885887
DOI: 10.1002/PRO.3941
Page generated: Mon Aug 12 18:23:45 2024

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