Chlorine in PDB 5cgm: Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution

All present enzymatic activity of Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution:
2.4.99.16;

The structure of Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution, PDB code: 5cgm was solved by V.Mendes, M.Blaszczyk, A.Maranha, N.Empadinhas, T.L.Blundell, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.66 / 1.95
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	80.330, 113.900, 220.500, 90.00, 90.00, 90.00
R / Rfree (%)	17.5 / 20.3

The structure of Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution also contains other interesting chemical elements:

Sodium

(Na)

19 atoms

The binding sites of Chlorine atom in the Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution (pdb code 5cgm). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution, PDB code: 5cgm:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl715 b:51.9 occ:1.00 O A:HOH832 2.6 16.1 1.0 O A:HOH1279 2.7 34.1 1.0 O A:HOH1014 2.7 21.2 1.0 OG A:SER530 3.1 18.2 0.5 CB A:SER530 3.7 16.2 0.5 OG A:SER530 3.7 20.6 0.5 CB A:SER530 3.7 15.6 0.5 CB A:MET232 3.8 22.8 1.0 O A:HOH1280 4.2 38.1 1.0 NH1 A:ARG558 4.3 18.0 1.0 NA A:NA712 4.3 47.4 1.0 CE2 A:PHE560 4.3 23.9 1.0 CZ A:PHE560 4.4 22.1 1.0 CA A:MET232 4.5 18.7 1.0 OE2 A:GLU551 4.5 16.9 1.0 CG2 A:THR237 4.6 17.8 1.0 N A:PHE233 4.6 15.6 1.0 O A:PHE233 4.7 19.2 1.0 CB A:SER236 4.7 17.1 1.0 O A:SER236 4.8 21.5 1.0 SD A:MET232 4.8 37.0 1.0 CG A:MET232 4.9 29.9 1.0

Chlorine binding site 2 out of 2 in the Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of Mycobacterium Thermoresistibile Glge in Complex with Maltose at 1.95A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl712 b:54.0 occ:1.00 O B:LEU456 2.5 24.2 1.0 OH B:TYR56 2.8 24.3 1.0 O B:HOH894 2.8 24.0 1.0 CE1 B:TYR56 3.3 27.4 1.0 CA B:GLY457 3.4 22.2 1.0 C B:LEU456 3.4 25.1 1.0 CZ B:TYR56 3.5 29.4 1.0 CG2 B:ILE427 3.6 24.8 1.0 CD1 B:LEU59 3.6 29.9 1.0 CB B:ILE427 3.8 25.2 1.0 N B:GLY457 3.8 22.3 1.0 O B:ALA424 4.0 25.5 1.0 CA B:ALA424 4.1 22.5 1.0 CG B:LEU59 4.3 29.8 1.0 CB B:LEU59 4.5 25.9 1.0 C B:GLY457 4.5 23.7 1.0 N B:GLY428 4.5 23.9 1.0 C B:ALA424 4.6 26.8 1.0 CD1 B:TYR56 4.6 24.9 1.0 CD1 B:ILE427 4.7 27.6 1.0 CB B:ALA424 4.7 23.3 1.0 CA B:LEU456 4.7 22.1 1.0 O B:GLY457 4.8 23.3 1.0 C B:ILE427 4.8 25.3 1.0 CA B:ILE427 4.8 22.1 1.0 O B:PRO57 4.8 32.7 1.0 CE2 B:TYR56 4.8 24.5 1.0 CG1 B:ILE427 4.9 24.2 1.0 O B:HOH976 4.9 41.4 1.0 O B:TRP423 4.9 22.5 1.0

V.Mendes, M.Blaszczyk, A.Maranha, N.Empadinhas, T.L.Blundell. Structure of Mycobacterium Thermoresistibile Glge Defines Novel Conformational States That Contribute to the Catalytic Mechanism. Sci Rep V. 5 17144 2015.
ISSN: ESSN 2045-2322
PubMed: 26616850
DOI: 10.1038/SREP17144