2Y46

Structure of the mixed-function P450 MycG in complex with mycinamicin IV in C 2 2 21 space group

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	0017000	biological_process	antibiotic biosynthetic process
A	0020037	molecular_function	heme binding
A	0046872	molecular_function	metal ion binding
A	0055114	biological_process	obsolete oxidation-reduction process
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	0017000	biological_process	antibiotic biosynthetic process
B	0020037	molecular_function	heme binding
B	0046872	molecular_function	metal ion binding
B	0055114	biological_process	obsolete oxidation-reduction process
C	0004497	molecular_function	monooxygenase activity
C	0005506	molecular_function	iron ion binding
C	0016705	molecular_function	oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
C	0017000	biological_process	antibiotic biosynthetic process
C	0020037	molecular_function	heme binding
C	0046872	molecular_function	metal ion binding
C	0055114	biological_process	obsolete oxidation-reduction process

Functional Information from PDB Data

site_id	AC1
Number of Residues	21
Details	BINDING SITE FOR RESIDUE HEM A 450

Chain	Residue
A	LEU83
A	ARG288
A	GLY338
A	PHE339
A	GLY340
A	HIS344
A	CYS346
A	LEU347
A	GLY348
A	MIV460
A	HOH2179
A	LEU84
A	HOH2289
A	HOH2290
A	HIS91
A	ARG95
A	ALA234
A	GLY235
A	SER238
A	THR239
A	PHE286

---

site_id	AC2
Number of Residues	15
Details	BINDING SITE FOR RESIDUE MIV A 460

Chain	Residue
A	ARG75
A	GLU77
A	VAL79
A	GLY81
A	GLY82
A	LEU84
A	SER170
A	VAL174
A	GLY230
A	VAL233
A	ALA234
A	GLU237
A	LEU386
A	HEM450
A	HOH2291

---

site_id	AC3
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN A 1398

Chain	Residue
A	HIS119
A	ARG366
A	HOH2142
A	HOH2292
B	HIS119
B	GLN365
B	ARG366
B	BEN1398
B	HOH2313

---

site_id	AC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL A 1399

Chain	Residue
A	ARG140
A	THR240
A	THR241
A	ALA244
A	GLY389
A	PRO390
A	HOH2162

---

site_id	AC5
Number of Residues	11
Details	BINDING SITE FOR RESIDUE GOL A 1400

Chain	Residue
A	LEU56
A	GLY57
A	GLY59
A	PHE61
A	PRO88
A	GLY342
A	VAL343
A	HOH2109
C	ASP325
C	HOH2253
C	HOH2254

---

site_id	AC6
Number of Residues	22
Details	BINDING SITE FOR RESIDUE HEM B 450

Chain	Residue
B	LEU83
B	LEU84
B	HIS91
B	ARG95
B	PHE102
B	ALA234
B	GLY235
B	SER238
B	THR239
B	PHE286
B	ARG288
B	GLY338
B	PHE339
B	GLY340
B	HIS344
B	CYS346
B	GLY348
B	ALA352
B	MIV460
B	HOH2184
B	HOH2309
B	HOH2310

---

site_id	AC7
Number of Residues	17
Details	BINDING SITE FOR RESIDUE MIV B 460

Chain	Residue
B	HEM450
B	HOH2155
B	HOH2312
B	ARG75
B	VAL79
B	GLY81
B	GLY82
B	LEU84
B	PHE168
B	SER170
B	VAL174
B	ALA176
B	MET179
B	VAL233
B	ALA234
B	GLU237
B	LEU386

---

site_id	AC8
Number of Residues	9
Details	BINDING SITE FOR RESIDUE BEN B 1398

Chain	Residue
A	HIS119
A	ARG366
A	BEN1398
A	HOH2142
A	HOH2292
B	HIS119
B	GLN365
B	ARG366
B	HOH2313

---

site_id	AC9
Number of Residues	12
Details	BINDING SITE FOR RESIDUE GOL B 1399

Chain	Residue
B	LEU56
B	GLY57
B	ASP58
B	GLY59
B	PHE61
B	PRO88
B	ASP325
B	GLY342
B	VAL343
B	HOH2102
B	HOH2252
B	HOH2254

---

site_id	BC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL B 1400

Chain	Residue
B	ARG140
B	THR240
B	THR241
B	ALA244
B	GLY389
B	PRO390
B	LEU391
B	HOH2160
B	HOH2185

---

site_id	BC2
Number of Residues	20
Details	BINDING SITE FOR RESIDUE HEM C 450

Chain	Residue
C	LEU83
C	LEU84
C	HIS91
C	ARG95
C	ALA234
C	GLY235
C	SER238
C	THR239
C	PHE286
C	ARG288
C	GLY338
C	PHE339
C	GLY340
C	HIS344
C	CYS346
C	LEU347
C	GLY348
C	HOH2192
C	HOH2307
C	HOH2308

---

site_id	BC3
Number of Residues	14
Details	BINDING SITE FOR RESIDUE MIV C 460

Chain	Residue
C	ARG75
C	VAL79
C	GLY81
C	GLY82
C	LEU84
C	VAL174
C	ALA176
C	MET179
C	GLY230
C	VAL233
C	ALA234
C	LEU386
C	HOH2164
C	HOH2309

---

site_id	BC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE BEN C 1398

Chain	Residue
C	HIS119
C	HIS119
C	ARG366
C	ARG366
C	HOH2310
C	HOH2310
C	HOH2311

---

site_id	BC5
Number of Residues	12
Details	BINDING SITE FOR RESIDUE GOL C 1399

Chain	Residue
A	ASP325
A	HOH2236
A	HOH2237
C	LEU56
C	GLY57
C	ASP58
C	GLY59
C	PHE61
C	PRO88
C	GLY342
C	VAL343
C	HOH2104

---

site_id	BC6
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL C 1400

Chain	Residue
C	ARG140
C	THR240
C	THR241
C	ALA244
C	GLY389
C	PRO390
C	LEU391
C	HOH2168

---

Functional Information from PROSITE/UniProt

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

Chain	Residue	Details
A	PHE339-GLY348

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	3
Details	BINDING: BINDING => ECO:0000269|PubMed:22952225, ECO:0007744|PDB:2Y46, ECO:0007744|PDB:2Y98, ECO:0007744|PDB:3ZSN

Chain	Residue	Details
A	GLY81
B	GLY81
C	GLY81

---

site_id	SWS_FT_FI2
Number of Residues	12
Details	BINDING: BINDING => ECO:0000269|PubMed:22952225

Chain	Residue	Details
A	HIS91
C	ARG95
C	ARG288
C	HIS344
A	ARG95
A	ARG288
A	HIS344
B	HIS91
B	ARG95
B	ARG288
B	HIS344
C	HIS91

---

site_id	SWS_FT_FI3
Number of Residues	3
Details	BINDING: axial binding residue => ECO:0000269|PubMed:22952225, ECO:0007744|PDB:2Y5N, ECO:0007744|PDB:2Y98, ECO:0007744|PDB:2YCA

Chain	Residue	Details
A	CYS346
B	CYS346
C	CYS346

---