4P1C

CRYSTAL STRUCTURE OF THE TOLUENE 4-MONOOXYGENASE HYDROXYLASE-FERREDOXIN C7S, C84A, C85A VARIANT ELECTRON-TRANSFER COMPLEX

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004497	molecular_function	monooxygenase activity
A	0006725	biological_process	obsolete cellular aromatic compound metabolic process
A	0016491	molecular_function	oxidoreductase activity
A	0018638	molecular_function	toluene 4-monooxygenase activity
A	0019439	biological_process	obsolete aromatic compound catabolic process
A	0042203	biological_process	toluene catabolic process
A	0046872	molecular_function	metal ion binding
B	0004497	molecular_function	monooxygenase activity
B	0006725	biological_process	obsolete cellular aromatic compound metabolic process
B	0016491	molecular_function	oxidoreductase activity
B	0016709	molecular_function	oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen
B	0018638	molecular_function	toluene 4-monooxygenase activity
B	0019439	biological_process	obsolete aromatic compound catabolic process
B	0042203	biological_process	toluene catabolic process
C	0004497	molecular_function	monooxygenase activity
C	0018638	molecular_function	toluene 4-monooxygenase activity
C	0019439	biological_process	obsolete aromatic compound catabolic process
C	0042203	biological_process	toluene catabolic process
D	0004497	molecular_function	monooxygenase activity
D	0006725	biological_process	obsolete cellular aromatic compound metabolic process
D	0016491	molecular_function	oxidoreductase activity
D	0018638	molecular_function	toluene 4-monooxygenase activity
D	0019439	biological_process	obsolete aromatic compound catabolic process
D	0042203	biological_process	toluene catabolic process
D	0046872	molecular_function	metal ion binding
E	0004497	molecular_function	monooxygenase activity
E	0006725	biological_process	obsolete cellular aromatic compound metabolic process
E	0016491	molecular_function	oxidoreductase activity
E	0016709	molecular_function	oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen
E	0018638	molecular_function	toluene 4-monooxygenase activity
E	0019439	biological_process	obsolete aromatic compound catabolic process
E	0042203	biological_process	toluene catabolic process
F	0004497	molecular_function	monooxygenase activity
F	0018638	molecular_function	toluene 4-monooxygenase activity
F	0019439	biological_process	obsolete aromatic compound catabolic process
F	0042203	biological_process	toluene catabolic process
H	0019439	biological_process	obsolete aromatic compound catabolic process
H	0042203	biological_process	toluene catabolic process
H	0046872	molecular_function	metal ion binding
H	0051537	molecular_function	2 iron, 2 sulfur cluster binding
I	0019439	biological_process	obsolete aromatic compound catabolic process
I	0042203	biological_process	toluene catabolic process
I	0046872	molecular_function	metal ion binding
I	0051537	molecular_function	2 iron, 2 sulfur cluster binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	binding site for residue FE A 501

Chain	Residue
A	GLU104
A	GLU134
A	HIS137
A	FE502
A	PEG503
A	HOH705

---

site_id	AC2
Number of Residues	6
Details	binding site for residue FE A 502

Chain	Residue
A	HIS234
A	FE501
A	PEG503
A	GLU134
A	GLU197
A	GLU231

---

site_id	AC3
Number of Residues	7
Details	binding site for residue PEG A 503

Chain	Residue
A	GLU104
A	GLU134
A	GLU197
A	FE501
A	FE502
A	HOH705
A	HOH769

---

site_id	AC4
Number of Residues	6
Details	binding site for residue FE D 501

Chain	Residue
D	GLU104
D	GLU134
D	HIS137
D	FE502
D	PEG503
D	HOH749

---

site_id	AC5
Number of Residues	7
Details	binding site for residue FE D 502

Chain	Residue
D	GLU134
D	GLU197
D	GLU231
D	HIS234
D	FE501
D	PEG503
D	HOH753

---

site_id	AC6
Number of Residues	11
Details	binding site for residue PEG D 503

Chain	Residue
D	ILE100
D	GLY103
D	GLU104
D	ALA107
D	GLU134
D	PHE176
D	GLU197
D	FE501
D	FE502
D	HOH749
D	HOH753

---

site_id	AC7
Number of Residues	7
Details	binding site for residue FES H 201

Chain	Residue
H	CYS45
H	HIS47
H	GLN48
H	ILE50
H	CYS64
H	HIS67
H	TRP69

---

site_id	AC8
Number of Residues	6
Details	binding site for residue FES I 201

Chain	Residue
I	CYS45
I	HIS47
I	GLN48
I	CYS64
I	HIS67
I	TRP69

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	8
Details	BINDING: BINDING => ECO:0000269|PubMed:15452777, ECO:0000269|PubMed:16627939, ECO:0000269|PubMed:17850744, ECO:0000269|PubMed:25248368, ECO:0007744|PDB:1SJG, ECO:0007744|PDB:1VM9, ECO:0007744|PDB:2Q3W, ECO:0007744|PDB:4P1B, ECO:0007744|PDB:4P1C

Chain	Residue	Details
I	CYS45
I	HIS47
I	CYS64
I	HIS67
D	HIS137
D	GLU197
D	GLU231
D	HIS234
H	CYS45
H	HIS47
H	CYS64
H	HIS67

---