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Ligands
Code Name Style Show Link
CL Chloride ion
HEM Protoporphyrin ix containing Fe
CA Calcium ion
JXP 7-[(4-chloro-3'-fluoro[1,1'-biphenyl]-3-yl)methoxy]-1h-[1,2,3]triazolo[4,5-B]pyridin-5-amine
Non-standard Residues
Code Name Show
Glycosylation
Code Name Emphasize
NAG 2-acetamido-2-deoxy-beta-D-glucopyranose
BMA Beta-D-mannopyranose
MAN Alpha-D-mannopyranose
FUC Alpha-L-fucopyranose
Modification
Code Name Show
Code : 5QJ3   PDBj   RCSB PDB   PDBe
Header : METAL BINDING PROTEIN
Title : CRYSTAL STRUCTURE OF MYELOPEROXIDASE SUBFORM C (MPO) COMPLEX WITH COMPOUND-24 AKA 7-({4-CHLORO-3'-FLUORO-[1,1'- BIPHENYL]-3-YL}METHOXY)-3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN- 5-AMINE
Release Data : 2019-02-06
Compound :
mol_id molecule chains synonym
1 Myeloperoxidase A,D MPO
ec: 1.11.2.2
mol_id molecule chains synonym
2 Myeloperoxidase B,E MPO
ec: 1.11.2.2
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Homo sapiens  (taxid:9606)
expression_system_common: Human
mol_id organism_scientific organism_common expression_system
2 Homo sapiens  (taxid:9606) Human Homo sapiens  (taxid:9606)
expression_system_common: Human
Authors : Khan, J.A.
Keywords : MYELOPEROXIDASE, METAL BINDING PROTEIN
Exp. method : X-RAY DIFFRACTION ( 2.7600 Å )
Citation :

Potent Triazolopyridine Myeloperoxidase Inhibitors.

Wurtz, N.R.,Viet, A.,Shaw, S.A.  et al.
(2018)  ACS Med Chem Lett  9 : 1175 - 1180

PubMed: 30613322
DOI: 10.1021/acsmedchemlett.8b00308

Chain : B, E
UniProt : P05164 (PERM_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
chloride + H(+) + H2O2 = H2O + hypochlorous acid 1.11.2.2 PubMed:9922160
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