Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

4Y4N

Thiazole synthase Thi4 from Methanococcus igneus

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0005506	molecular_function	iron ion binding
A	0009228	biological_process	thiamine biosynthetic process
A	0009229	biological_process	thiamine diphosphate biosynthetic process
A	0016740	molecular_function	transferase activity
A	0016763	molecular_function	pentosyltransferase activity
A	0046872	molecular_function	metal ion binding
A	0052837	biological_process	thiazole biosynthetic process
B	0005506	molecular_function	iron ion binding
B	0009228	biological_process	thiamine biosynthetic process
B	0009229	biological_process	thiamine diphosphate biosynthetic process
B	0016740	molecular_function	transferase activity
B	0016763	molecular_function	pentosyltransferase activity
B	0046872	molecular_function	metal ion binding
B	0052837	biological_process	thiazole biosynthetic process
C	0005506	molecular_function	iron ion binding
C	0009228	biological_process	thiamine biosynthetic process
C	0009229	biological_process	thiamine diphosphate biosynthetic process
C	0016740	molecular_function	transferase activity
C	0016763	molecular_function	pentosyltransferase activity
C	0046872	molecular_function	metal ion binding
C	0052837	biological_process	thiazole biosynthetic process
D	0005506	molecular_function	iron ion binding
D	0009228	biological_process	thiamine biosynthetic process
D	0009229	biological_process	thiamine diphosphate biosynthetic process
D	0016740	molecular_function	transferase activity
D	0016763	molecular_function	pentosyltransferase activity
D	0046872	molecular_function	metal ion binding
D	0052837	biological_process	thiazole biosynthetic process
E	0005506	molecular_function	iron ion binding
E	0009228	biological_process	thiamine biosynthetic process
E	0009229	biological_process	thiamine diphosphate biosynthetic process
E	0016740	molecular_function	transferase activity
E	0016763	molecular_function	pentosyltransferase activity
E	0046872	molecular_function	metal ion binding
E	0052837	biological_process	thiazole biosynthetic process
F	0005506	molecular_function	iron ion binding
F	0009228	biological_process	thiamine biosynthetic process
F	0009229	biological_process	thiamine diphosphate biosynthetic process
F	0016740	molecular_function	transferase activity
F	0016763	molecular_function	pentosyltransferase activity
F	0046872	molecular_function	metal ion binding
F	0052837	biological_process	thiazole biosynthetic process
G	0005506	molecular_function	iron ion binding
G	0009228	biological_process	thiamine biosynthetic process
G	0009229	biological_process	thiamine diphosphate biosynthetic process
G	0016740	molecular_function	transferase activity
G	0016763	molecular_function	pentosyltransferase activity
G	0046872	molecular_function	metal ion binding
G	0052837	biological_process	thiazole biosynthetic process
H	0005506	molecular_function	iron ion binding
H	0009228	biological_process	thiamine biosynthetic process
H	0009229	biological_process	thiamine diphosphate biosynthetic process
H	0016740	molecular_function	transferase activity
H	0016763	molecular_function	pentosyltransferase activity
H	0046872	molecular_function	metal ion binding
H	0052837	biological_process	thiazole biosynthetic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	4
Details	binding site for residue FE2 A 301

Chain	Residue
A	HIS176
A	48H302
A	HOH401
C	ASP161

site_id	AC2
Number of Residues	30
Details	binding site for residue 48H A 302

Chain	Residue
A	LEU58
A	GLU59
A	ARG60
A	HIS61
A	GLY66
A	GLY67
A	ILE131
A	VAL133
A	ALA173
A	THR174
A	GLY175
A	HIS176
A	SER179
A	GLY225
A	MET226
A	ARG236
A	MET237
A	GLY238
A	MET244
A	FE2301
A	HOH401
A	HOH402
A	HOH405
A	HOH406
C	ASP161
A	VAL35
A	GLY36
A	GLY38
A	PRO39
A	SER40

site_id	AC3
Number of Residues	4
Details	binding site for residue FE2 A 303

Chain	Residue
A	ASP161
A	48H304
A	HOH403
H	HIS176

site_id	AC4
Number of Residues	33
Details	binding site for residue 48H A 304

Chain	Residue
A	ASP161
A	FE2303
A	HOH403
A	HOH431
A	HOH432
H	VAL35
H	GLY36
H	GLY38
H	PRO39
H	SER40
H	LEU58
H	GLU59
H	ARG60
H	HIS61
H	GLY66
H	GLY67
H	ILE131
H	VAL132
H	VAL133
H	ALA173
H	THR174
H	GLY175
H	HIS176
H	SER179
H	MET201
H	GLY225
H	MET226
H	ARG236
H	MET237
H	GLY238
H	PHE241
H	MET244
H	HOH302

site_id	AC5
Number of Residues	4
Details	binding site for residue FE2 B 301

Chain	Residue
B	HIS176
B	48H302
D	ASP161
D	HOH405

site_id	AC6
Number of Residues	32
Details	binding site for residue 48H B 302

Chain	Residue
B	PHE241
B	MET244
B	FE2301
B	HOH402
B	HOH403
D	ASP161
D	HOH405
D	HOH406
B	VAL35
B	GLY36
B	GLY38
B	PRO39
B	SER40
B	LEU58
B	GLU59
B	ARG60
B	HIS61
B	GLY66
B	GLY67
B	ILE131
B	VAL133
B	ALA173
B	THR174
B	GLY175
B	HIS176
B	SER179
B	MET201
B	GLY225
B	MET226
B	ARG236
B	MET237
B	GLY238

site_id	AC7
Number of Residues	4
Details	binding site for residue FE2 B 303

Chain	Residue
B	ASP161
B	48H304
B	HOH426
G	HIS176

site_id	AC8
Number of Residues	30
Details	binding site for residue 48H B 304

Chain	Residue
B	ASP161
B	FE2303
B	HOH426
B	HOH427
B	HOH428
B	HOH429
G	VAL35
G	GLY36
G	GLY38
G	PRO39
G	SER40
G	LEU58
G	GLU59
G	ARG60
G	HIS61
G	GLY66
G	GLY67
G	ILE131
G	VAL132
G	VAL133
G	ALA173
G	THR174
G	GLY175
G	HIS176
G	SER179
G	GLY225
G	MET226
G	ARG236
G	GLY238
G	MET244

site_id	AC9
Number of Residues	4
Details	binding site for residue FE2 C 301

Chain	Residue
C	HIS176
C	48H302
F	ASP161
F	HOH405

site_id	AD1
Number of Residues	30
Details	binding site for residue 48H C 302

Chain	Residue
C	VAL35
C	GLY36
C	GLY38
C	PRO39
C	SER40
C	LEU58
C	GLU59
C	ARG60
C	HIS61
C	GLY66
C	GLY67
C	ILE131
C	VAL132
C	VAL133
C	ALA173
C	THR174
C	GLY175
C	HIS176
C	SER179
C	MET201
C	GLY225
C	MET226
C	ARG236
C	GLY238
C	MET244
C	FE2301
C	HOH402
C	HOH403
F	ASP161
F	HOH406

site_id	AD2
Number of Residues	4
Details	binding site for residue FE2 D 301

Chain	Residue
D	HIS176
D	48H302
E	ASP161
E	HOH401

site_id	AD3
Number of Residues	31
Details	binding site for residue 48H D 302

Chain	Residue
D	VAL35
D	GLY36
D	GLY38
D	PRO39
D	SER40
D	LEU58
D	GLU59
D	ARG60
D	HIS61
D	GLY66
D	GLY67
D	ILE131
D	VAL133
D	ALA173
D	THR174
D	GLY175
D	HIS176
D	SER179
D	GLY225
D	MET226
D	ARG236
D	MET237
D	GLY238
D	PHE241
D	MET244
D	FE2301
D	HOH407
D	HOH408
E	ASP161
E	HOH401
E	HOH410

site_id	AD4
Number of Residues	4
Details	binding site for residue FE2 E 301

Chain	Residue
E	HIS176
E	48H302
G	ASP161
G	HOH402

site_id	AD5
Number of Residues	33
Details	binding site for residue 48H E 302

Chain	Residue
E	VAL35
E	GLY36
E	GLY38
E	PRO39
E	SER40
E	LEU58
E	GLU59
E	ARG60
E	HIS61
E	GLY66
E	GLY67
E	ILE131
E	VAL132
E	VAL133
E	ALA173
E	THR174
E	GLY175
E	HIS176
E	SER179
E	MET201
E	GLY225
E	MET226
E	ARG236
E	MET237
E	GLY238
E	PHE241
E	MET244
E	FE2301
E	HOH402
E	HOH403
G	ASP161
G	HOH402
G	HOH403

site_id	AD6
Number of Residues	4
Details	binding site for residue FE2 F 301

Chain	Residue
F	HIS176
F	48H302
H	ASP161
H	HOH301

site_id	AD7
Number of Residues	31
Details	binding site for residue 48H F 302

Chain	Residue
F	VAL35
F	GLY36
F	GLY38
F	PRO39
F	SER40
F	LEU58
F	GLU59
F	ARG60
F	HIS61
F	GLY66
F	GLY67
F	ILE131
F	VAL133
F	ALA173
F	THR174
F	GLY175
F	HIS176
F	SER179
F	GLY225
F	MET226
F	ARG236
F	MET237
F	GLY238
F	PHE241
F	MET244
F	FE2301
F	HOH407
F	HOH408
F	HOH409
H	ASP161
H	HOH301

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	48
Details	BINDING: in other chain => ECO:0000305\|PubMed:26919468

Chain	Residue	Details
A	SER40
B	VAL133
B	SER179
B	MET226
C	SER40
C	GLU59
C	GLY67
C	VAL133
C	SER179
C	MET226
D	SER40
A	GLU59
D	GLU59
D	GLY67
D	VAL133
D	SER179
D	MET226
E	SER40
E	GLU59
E	GLY67
E	VAL133
E	SER179
A	GLY67
E	MET226
F	SER40
F	GLU59
F	GLY67
F	VAL133
F	SER179
F	MET226
G	SER40
G	GLU59
G	GLY67
A	VAL133
G	VAL133
G	SER179
G	MET226
H	SER40
H	GLU59
H	GLY67
H	VAL133
H	SER179
H	MET226
A	SER179
A	MET226
B	SER40
B	GLU59
B	GLY67

site_id	SWS_FT_FI2
Number of Residues	8
Details	BINDING: BINDING => ECO:0000255\|HAMAP-Rule:MF_00304

Chain	Residue	Details
A	HIS159
B	HIS159
C	HIS159
D	HIS159
E	HIS159
F	HIS159
G	HIS159
H	HIS159

site_id	SWS_FT_FI3
Number of Residues	8
Details	BINDING: BINDING => ECO:0000269\|PubMed:26919468

Chain	Residue	Details
A	ASP161
B	ASP161
C	ASP161
D	ASP161
E	ASP161
F	ASP161
G	ASP161
H	ASP161

site_id	SWS_FT_FI4
Number of Residues	8
Details	BINDING: in other chain => ECO:0000269\|PubMed:26919468

Chain	Residue	Details
A	HIS176
B	HIS176
C	HIS176
D	HIS176
E	HIS176
F	HIS176
G	HIS176
H	HIS176

site_id	SWS_FT_FI5
Number of Residues	8
Details	BINDING: BINDING => ECO:0000305\|PubMed:26919468

Chain	Residue	Details
A	ARG236
B	ARG236
C	ARG236
D	ARG236
E	ARG236
F	ARG236
G	ARG236
H	ARG236

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