Danish

PDB ID: 5qj2

CRYSTAL STRUCTURE OF MYELOPEROXIDASE SUBFORM C (MPO) OMPLEX WITH COMPOUND-20 AKA 7-((3-(1-METHYL-1H-PYRAZOL-3- YL)BENZYL)OXY)- 1H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-5-AMINE
Experimental method: X-RAY DIFFRACTION
Resolution: 2.82 Å
Deposition date: 2018-09-26

Number of assemblies: 4

Assembly ID: 1 (author_and_software_defined_assembly)
Structural data	PDB
Oligomeric count	2
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	I, J, K, L, M, N, O, Q, R, S, T, U, V, W

Each chain information

Chain A
auth_asym_id	A
Residue indices (Uniprot)	1-103 (167-271)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain B
auth_asym_id	B
Residue indices (Uniprot)	113-577 (278-744)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	P
Available structure	PDB

Assembly ID: 2 (author_and_software_defined_assembly)
Structural data	PDB
Oligomeric count	2
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	AA, BA, CA, DA, EA, GA, HA, X, Y, Z

Each chain information

Chain C
auth_asym_id	D
Residue indices (Uniprot)	1-103 (167-271)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain D
auth_asym_id	E
Residue indices (Uniprot)	113-577 (278-744)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	115:125
label_asym_ids of heme	FA
Available structure	PDB

Assembly ID: 3 (author_and_software_defined_assembly)
Structural data	PDB
Oligomeric count	2
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	IA, JA, KA, LA, MA, NA, PA, QA, RA, SA, TA, UA, VA

Each chain information

Chain E
auth_asym_id	F
Residue indices (Uniprot)	1-103 (167-271)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain F
auth_asym_id	G
Residue indices (Uniprot)	113-577 (278-744)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	OA
Available structure	PDB

Assembly ID: 4 (author_and_software_defined_assembly)
Structural data	PDB
Oligomeric count	2
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	AB, BB, CB, DB, EB, GB, WA, XA, YA, ZA

Each chain information

Chain G
auth_asym_id	H
Residue indices (Uniprot)	1-103 (167-271)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain H
auth_asym_id	I
Residue indices (Uniprot)	113-577 (278-744)
Uniprot ID	P05164 ￫UniprotKB
label_asym_ids of heme	FB
Available structure	PDB