Sodium in PDB 4w78: Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis

The structure of Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis, PDB code: 4w78 was solved by K.E.Guja, M.Yang, N.Sampson, M.Garcia-Diaz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	37.60 / 1.54
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	51.785, 134.096, 90.420, 90.00, 91.58, 90.00
R / Rfree (%)	17.7 / 20.5

The structure of Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis also contains other interesting chemical elements:

Cadmium	(Cd)	13 atoms
Chlorine	(Cl)	4 atoms
Calcium	(Ca)	2 atoms

The binding sites of Sodium atom in the Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis (pdb code 4w78). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total only one binding site of Sodium was determined in the Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis, PDB code: 4w78:

Sodium binding site 1 out of 1 in the Crystal Structure of the CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis


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 CHSH1-CHSH2 Complex From Mycobacterium Tuberculosis within 5.0Å range: probe atom residue distance (Å) B Occ D:Na205 b:20.7 occ:1.00 O D:HOH333 2.1 21.4 1.0 O D:HOH366 2.1 29.4 1.0 O D:HOH391 2.2 37.5 1.0 OD1 D:ASP32 2.2 27.7 0.4 O H:HOH376 2.2 37.5 1.0 OG1 H:THR18 2.3 16.3 1.0 CG D:ASP32 2.7 23.9 0.4 OD2 D:ASP32 2.7 26.6 0.4 CB H:THR18 3.2 14.9 1.0 CB D:ASP32 3.8 22.1 0.6 CB D:ASP32 4.1 21.3 0.4 CG2 H:THR18 4.2 16.4 1.0 OD2 D:ASP32 4.2 26.4 0.6 OD2 D:ASP36 4.2 19.9 1.0 OD2 H:ASP16 4.2 35.4 1.0 N H:THR18 4.3 13.8 1.0 CA H:THR18 4.3 12.9 1.0 CG D:ASP32 4.5 23.6 0.6 NE2 D:HIS35 4.5 18.8 1.0 O D:HOH377 4.6 34.6 1.0 CG H:ASP16 4.6 27.8 1.0 CA D:ASP32 4.8 18.2 0.6 CA D:ASP32 4.8 18.6 0.4 OD1 H:ASP16 4.9 26.5 1.0 O H:HOH385 4.9 40.2 1.0 CG D:LYS39 4.9 23.4 1.0 O D:HOH346 5.0 26.0 1.0

M.Yang, K.E.Guja, S.T.Thomas, M.Garcia-Diaz, N.S.Sampson. A Distinct Maoc-Like Enoyl-Coa Hydratase Architecture Mediates Cholesterol Catabolism in Mycobacterium Tuberculosis. Acs Chem.Biol. 2014.
ISSN: ESSN 1554-8937
PubMed: 25203216
DOI: 10.1021/CB500232H