5TDV

Intermediate O2 diiron complex in the Q228A variant of Toluene 4-moonoxygenase (T4moHD)

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004497	molecular_function	monooxygenase activity
A	0009056	biological_process	catabolic process
A	0016491	molecular_function	oxidoreductase activity
A	0018638	molecular_function	toluene 4-monooxygenase activity
A	0042203	biological_process	toluene catabolic process
A	0046872	molecular_function	metal ion binding
B	0004497	molecular_function	monooxygenase activity
B	0009056	biological_process	catabolic 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	0042203	biological_process	toluene catabolic process
C	0004497	molecular_function	monooxygenase activity
C	0009056	biological_process	catabolic process
C	0018638	molecular_function	toluene 4-monooxygenase activity
C	0042203	biological_process	toluene catabolic process
D	0004497	molecular_function	monooxygenase activity
D	0009056	biological_process	catabolic process
D	0016491	molecular_function	oxidoreductase activity
D	0018638	molecular_function	toluene 4-monooxygenase activity
D	0042203	biological_process	toluene catabolic process
D	0046872	molecular_function	metal ion binding
E	0004497	molecular_function	monooxygenase activity
E	0009056	biological_process	catabolic process
E	0042203	biological_process	toluene catabolic process
F	0004497	molecular_function	monooxygenase activity
F	0009056	biological_process	catabolic process
F	0016491	molecular_function	oxidoreductase activity
F	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
F	0018638	molecular_function	toluene 4-monooxygenase activity
F	0042203	biological_process	toluene catabolic process
G	0004497	molecular_function	monooxygenase activity
G	0009056	biological_process	catabolic process
G	0018638	molecular_function	toluene 4-monooxygenase activity
G	0042203	biological_process	toluene catabolic process
H	0004497	molecular_function	monooxygenase activity
H	0009056	biological_process	catabolic process
H	0042203	biological_process	toluene catabolic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	7
Details	binding site for residue PER A 601

Chain	Residue
A	GLU104
A	GLU134
A	GLU197
A	GLU231
A	FE602
A	FE603
A	HOH786

---

site_id	AC2
Number of Residues	7
Details	binding site for residue FE A 602

Chain	Residue
A	HIS137
A	GLU231
A	PER601
A	FE603
A	HOH733
A	GLU104
A	GLU134

---

site_id	AC3
Number of Residues	6
Details	binding site for residue FE A 603

Chain	Residue
A	GLU134
A	GLU197
A	GLU231
A	HIS234
A	PER601
A	FE602

---

site_id	AC4
Number of Residues	7
Details	binding site for residue PER D 601

Chain	Residue
D	GLU104
D	GLU134
D	GLU197
D	GLU231
D	FE602
D	FE603
D	HOH701

---

site_id	AC5
Number of Residues	7
Details	binding site for residue FE D 602

Chain	Residue
D	GLU104
D	GLU134
D	HIS137
D	GLU231
D	PER601
D	FE603
D	HOH738

---

site_id	AC6
Number of Residues	6
Details	binding site for residue FE D 603

Chain	Residue
D	GLU134
D	GLU197
D	GLU231
D	HIS234
D	PER601
D	FE602

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	12
Details	BINDING: BINDING => ECO:0000269|PubMed:19033467, ECO:0000269|PubMed:19290655, ECO:0000269|PubMed:19705873, ECO:0000269|PubMed:22264099, ECO:0000269|PubMed:25248368, ECO:0000269|PubMed:28346937, ECO:0007744|PDB:3Q14, ECO:0007744|PDB:3Q2A, ECO:0007744|PDB:3Q3M, ECO:0007744|PDB:3Q3N, ECO:0007744|PDB:3Q3O, ECO:0007744|PDB:3RI7, ECO:0007744|PDB:3RMK, ECO:0007744|PDB:4P1B, ECO:0007744|PDB:4P1C, ECO:0007744|PDB:5TDS, ECO:0007744|PDB:5TDT, ECO:0007744|PDB:5TDU, ECO:0007744|PDB:5TDV

Chain	Residue	Details
A	GLU104
D	GLU197
D	GLU231
D	HIS234
A	GLU134
A	HIS137
A	GLU197
A	GLU231
A	HIS234
D	GLU104
D	GLU134
D	HIS137

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