6SCZ: Mycobacterium tuberculosis alanine racemase inhibited by DCS

PDB ID: 6SCZDownload
MMDB ID: 185946
PDB Deposition Date: 2019/7/26
Updated in MMDB: 2020/06
Experimental Method:
x-ray diffraction
Resolution: 1.57  Å
Source Organism:
Similar Structures:
Biological Unit for 6SCZ: dimeric; determined by author and by software (PISA)
Molecular Components in 6SCZ
Label Count Molecule
Proteins (2 molecules)
2
Alanine Racemase
(Gene symbol: alr)
Molecule annotation
Chemicals and Non-standard biopolymers (50 molecules)
1
7
GLYCEROLGLYCEROL
2
1
CALCIUM IONCALCIUM ION
3
3
CHLORIDE IONCHLORIDE ION
4
22
1,2-ETHANEDIOL1,2-ETHANEDIOL
5
7
DI(HYDROXYETHYL)ETHERDI(HYDROXYETHYL)ETHER
6
5
polyethylene glycolpolyethylene glycol
7
1
(~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylidene-[(4~{R})-3-oxidanylidene-1,2-oxazolidin-4-yl]azanium(~{E})-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylidene-[(4~{R})-3-oxidanylidene-1,2-oxazolidin-4-yl]azanium
8
2
[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl-(3-oxidanyl-1,2-oxazol-4-yl)azanium[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl-(3-oxidanyl-1,2-oxazol-4-yl)azanium
9
2
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303