Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

1ZO4

Crystal Structure Of A328S Mutant Of The Heme Domain Of P450BM-3

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004497	molecular_function	monooxygenase activity
A	0005506	molecular_function	iron ion binding
A	0016705	molecular_function	oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
A	0020037	molecular_function	heme binding
B	0004497	molecular_function	monooxygenase activity
B	0005506	molecular_function	iron ion binding
B	0016705	molecular_function	oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
B	0020037	molecular_function	heme binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	26
Details	BINDING SITE FOR RESIDUE HEM A 471

Chain	Residue
A	LYS69
A	LEU272
A	THR327
A	PHE331
A	PRO392
A	PHE393
A	GLY394
A	ARG398
A	ALA399
A	CYS400
A	ILE401
A	LEU86
A	HOH1494
A	HOH1499
A	HOH1502
A	HOH1504
A	HOH1517
A	HOH1796
A	HOH1867
A	PHE87
A	TRP96
A	PHE107
A	ALA264
A	GLY265
A	THR268
A	THR269

site_id	AC2
Number of Residues	27
Details	BINDING SITE FOR RESIDUE HEM B 471

Chain	Residue
B	LYS69
B	LEU86
B	PHE87
B	TRP96
B	PHE107
B	ALA264
B	GLY265
B	THR268
B	THR269
B	LEU272
B	THR327
B	PHE331
B	PRO392
B	PHE393
B	GLY394
B	ARG398
B	ALA399
B	CYS400
B	ILE401
B	ALA406
B	HOH1493
B	HOH1494
B	HOH1496
B	HOH1499
B	HOH1500
B	HOH1540
B	HOH1895

site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MES B 1490

Chain	Residue
B	HIS285
B	ARG375
B	GLU377
B	HOH1546
B	HOH1871

site_id	AC4
Number of Residues	8
Details	BINDING SITE FOR RESIDUE MES A 1491

Chain	Residue
A	ILE366
A	TRP367
A	ARG375
A	GLU377
A	ARG378
A	ALA384
A	ILE385
A	PRO386

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL B 1470

Chain	Residue
A	GLN128
A	ARG132
B	ASP121
B	ARG161

site_id	AC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 1471

Chain	Residue
A	ASP338
A	GLU348
A	HOH1702
A	HOH1810

site_id	AC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL A 1472

Chain	Residue
A	TYR166
A	ARG167
A	HOH1550
B	LYS129
B	LEU133
B	ASP168
B	HOH1645
B	HOH1718

site_id	AC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL A 1473

Chain	Residue
A	ARG79
A	HOH1790
A	HOH1856

site_id	AC9
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL B 1474

Chain	Residue
B	PHE390
B	LYS391
B	PRO392
B	PHE393
B	GLY394
B	GLN403
B	GOL1475
B	HOH1559
B	HOH1835

site_id	BC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 1475

Chain	Residue
B	GOL1474
B	LYS391
B	GLY394
B	ASN395
B	GLY396
B	GLN403

site_id	BC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL B 1477

Chain	Residue
B	GLY83
B	ASP84
B	GLU252
B	TYR256
B	HOH1678

site_id	BC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL B 1478

Chain	Residue
B	GLU247
B	LYS282
B	HOH1676
B	HOH1879

site_id	BC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL B 1479

Chain	Residue
A	ARG132
B	ASP121
B	VAL124
B	HOH1668

site_id	BC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL A 1481

Chain	Residue
A	HIS285
A	LYS289
A	GLU377
A	HOH1690
A	HOH1853

site_id	BC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL A 1482

Chain	Residue
A	LYS289
A	TYR313
A	MET316
A	GLU380
A	HOH1731

site_id	BC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL B 1483

Chain	Residue
B	GLY240
B	LYS241
B	HOH1908

site_id	BC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 1484

Chain	Residue
A	MET5
A	LYS41
A	ARG50
A	HOH1597

site_id	BC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 1485

Chain	Residue
A	SER108
A	GOL1487
A	HOH1521
A	HOH1528

site_id	CC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL A 1486

Chain	Residue
A	TRP130
A	GLU131
A	LEU133
A	ASN134
A	ALA448
A	LYS449
A	SER450
A	HOH1586
A	HOH1676

site_id	CC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL A 1487

Chain	Residue
A	HIS100
A	GLY396
A	GLN397
A	GOL1485
A	HOH1567
A	HOH1658
A	HOH1735

site_id	CC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL B 1488

Chain	Residue
B	VAL302
B	PRO303
B	SER304
B	HOH1622
B	HOH1868

site_id	CC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 1489

Chain	Residue
A	PRO25
A	VAL26
A	LEU29
A	TYR51

Functional Information from PROSITE/UniProt

site_id	PS00086
Number of Residues	10
Details	CYTOCHROME_P450 Cytochrome P450 cysteine heme-iron ligand signature. FGnGQRACIG

Chain	Residue	Details
A	PHE393-GLY402

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"15020590","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1SMJ","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	2
Details	Binding site: {"description":"axial binding residue","evidences":[{"source":"PubMed","id":"10051560","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"11695889","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"11695892","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"14653735","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15020590","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15299332","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"16403573","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17077084","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17429965","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17868686","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18004886","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18298086","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18619466","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18721129","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19492389","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"20180779","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"20947800","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21110374","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21875028","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"7578081","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"8342039","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"9033595","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1BU7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1BVY","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1FAG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1FAH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1JME","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1JPZ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1P0V","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1P0W","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1P0X","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1SMI","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1SMJ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1YQO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1YQP","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1ZO4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1ZO9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1ZOA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2BMH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2HPD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2IJ2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2IJ3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2IJ4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2J1M","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2J4S","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2UWH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3BEN","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3CBD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3EKB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3EKD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3EKF","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3HF2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KX3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KX4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KX5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3M4V","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3NPL","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	2
Details	Site: {"description":"Important for catalytic activity","evidences":[{"source":"PubMed","id":"16403573","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"7578081","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

Catalytic Information from CSA

site_id	CSA1
Number of Residues	2
Details	Annotated By Reference To The Literature 1akd

Chain	Residue	Details
A	THR268
A	GLU267

site_id	CSA2
Number of Residues	2
Details	Annotated By Reference To The Literature 1akd

Chain	Residue	Details
B	THR268
B	GLU267

site_id	MCSA1
Number of Residues	3
Details	M-CSA 699

Chain	Residue	Details
A	THR268	electrostatic stabiliser, steric role
A	PHE393	electrostatic stabiliser, steric role
A	CYS400	electrostatic stabiliser

site_id	MCSA2
Number of Residues	3
Details	M-CSA 699

Chain	Residue	Details
B	THR268	electrostatic stabiliser, steric role
B	PHE393	electrostatic stabiliser, steric role
B	CYS400	electrostatic stabiliser

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)