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PDB ID: 7z53

Structure of native leukocyte myeloperoxidase in complex with a truncated version (SPIN truncated) of the Staphyloccal Peroxidase Inhibitor SPIN from Staphylococcus aureus
Experimental method: X-RAY DIFFRACTION
Resolution: 2.28 Å
Deposition date: 2022-03-07

Number of assemblies: 4

Assembly ID: 1 (author_defined_assembly)
Structural data	modeled
Oligomeric count	6
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	AA, AB, BA, BB, CA, CB, DB, UA, WA, XA, Y, YA, Z

Each chain information

Chain A
auth_asym_id	A
Residue indices (Uniprot)	167-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain B
auth_asym_id	B
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	VA
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.10 Å

Chain C
auth_asym_id	C
Residue indices (Uniprot)	166-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain D
auth_asym_id	D
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	ZA
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.10 Å

Chain E
auth_asym_id	E
Residue indices (Uniprot)	47-97 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain F
auth_asym_id	F
Residue indices (Uniprot)	47-103 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Assembly ID: 2 (author_defined_assembly)
Structural data	modeled
Oligomeric count	6
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	DA, EA, EB, FA, GA, GB, HA, HB, IB, KB

Each chain information

Chain G
auth_asym_id	G
Residue indices (Uniprot)	166-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain H
auth_asym_id	H
Residue indices (Uniprot)	279-744 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	FB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.11 Å

Chain I
auth_asym_id	I
Residue indices (Uniprot)	167-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain J
auth_asym_id	J
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	JB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.09 Å

Chain K
auth_asym_id	K
Residue indices (Uniprot)	46-100 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain L
auth_asym_id	L
Residue indices (Uniprot)	46-104 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Assembly ID: 3 (author_defined_assembly)
Structural data	modeled
Oligomeric count	6
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	IA, JA, KA, LA, LB, MA, NA, NB, OB, QB, RB, SB

Each chain information

Chain M
auth_asym_id	M
Residue indices (Uniprot)	167-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain N
auth_asym_id	N
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	MB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.11 Å

Chain O
auth_asym_id	O
Residue indices (Uniprot)	167-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain P
auth_asym_id	P
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	PB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.10 Å

Chain Q
auth_asym_id	Q
Residue indices (Uniprot)	46-100 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain R
auth_asym_id	R
Residue indices (Uniprot)	46-104 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Assembly ID: 4 (author_defined_assembly)
Structural data	modeled
Oligomeric count	6
label_asym_ids of protein
label_asym_ids of heme
label_asym_ids of the others	OA, PA, QA, RA, SA, TA, TB, VB, WB, YB

Each chain information

Chain S
auth_asym_id	S
Residue indices (Uniprot)	166-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain T
auth_asym_id	T
Residue indices (Uniprot)	279-743 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	UB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.10 Å

Chain U
auth_asym_id	U
Residue indices (Uniprot)	167-271 (166-271)
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	167:180
label_asym_ids of heme	None
Available structure	PDB

Chain V
auth_asym_id	V
Residue indices (Uniprot)	279-744 (279-744)
Nonstandard amino acids
Uniprot ID	P05164 ￫UniprotKB
S-S bonds	281:291,285:309,387:398,606:663,704:730
label_asym_ids of heme	XB
Available structure	PDB and Modeled
RMSD of modeled structure from PDB structure	0.10 Å

Chain W
auth_asym_id	W
Residue indices (Uniprot)	46-101 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB

Chain X
auth_asym_id	X
Residue indices (Uniprot)	46-100 (43-101)
Uniprot ID	Q2G0X2 ￫UniprotKB
label_asym_ids of heme	None
Available structure	PDB