6WY0: CRYSTAL STRUCTURE OF MYELOPEROXIDASE SUBFORM C (MPO) COMPLEX WITH Compound-40 A.K.A 7-[(1R)-1-phenyl-3-{[(1r,4r)-4-phenylcyclohexyl]amino}propyl]-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine

PDB ID: 6WY0Download
MMDB ID: 194170
PDB Deposition Date: 2020/5/12
Updated in MMDB: 2024/12
Experimental Method:
x-ray diffraction
Resolution: 2.799  Å
Source Organism:
Similar Structures:
Biological Unit for 6WY0: dimeric; determined by author and by software (PISA)
Molecular Components in 6WY0
Label Count Molecule
Proteins (2 molecules)
1
Myeloperoxidase Light Chain
(Gene symbol: MPO)
Molecule annotation
1
Myeloperoxidase Heavy Chain
(Gene symbol: MPO)
Molecule annotation
Chemicals and Non-standard biopolymers (15 molecules)
1
6
2-acetamido-2-deoxy-beta-D-glucopyranose2-acetamido-2-deoxy-beta-D-glucopyranose
2
1
alpha-L-fucopyranosealpha-L-fucopyranose
3
1
beta-D-mannopyranosebeta-D-mannopyranose
4
2
alpha-D-mannopyranosealpha-D-mannopyranose
5
1
HEME CHEME C
6
1
CALCIUM IONCALCIUM ION
7
2
CHLORIDE IONCHLORIDE ION
8
1
7-{(1R)-1-phenyl-3-[(trans-4-phenylcyclohexyl)amino]propyl}-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine7-{(1R)-1-phenyl-3-[(trans-4-phenylcyclohexyl)amino]propyl}-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
* 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