Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

4I42

E.coli. 1,4-dihydroxy-2-naphthoyl coenzyme A synthase (ecMenB) in complex with 1-hydroxy-2-naphthoyl-CoA

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0003824	molecular_function	catalytic activity
A	0005515	molecular_function	protein binding
A	0005829	cellular_component	cytosol
A	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
A	0009234	biological_process	menaquinone biosynthetic process
A	0016829	molecular_function	lyase activity
A	0071890	molecular_function	bicarbonate binding
B	0003824	molecular_function	catalytic activity
B	0005515	molecular_function	protein binding
B	0005829	cellular_component	cytosol
B	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
B	0009234	biological_process	menaquinone biosynthetic process
B	0016829	molecular_function	lyase activity
B	0071890	molecular_function	bicarbonate binding
C	0003824	molecular_function	catalytic activity
C	0005515	molecular_function	protein binding
C	0005829	cellular_component	cytosol
C	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
C	0009234	biological_process	menaquinone biosynthetic process
C	0016829	molecular_function	lyase activity
C	0071890	molecular_function	bicarbonate binding
D	0003824	molecular_function	catalytic activity
D	0005515	molecular_function	protein binding
D	0005829	cellular_component	cytosol
D	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
D	0009234	biological_process	menaquinone biosynthetic process
D	0016829	molecular_function	lyase activity
D	0071890	molecular_function	bicarbonate binding
E	0003824	molecular_function	catalytic activity
E	0005515	molecular_function	protein binding
E	0005829	cellular_component	cytosol
E	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
E	0009234	biological_process	menaquinone biosynthetic process
E	0016829	molecular_function	lyase activity
E	0071890	molecular_function	bicarbonate binding
F	0003824	molecular_function	catalytic activity
F	0005515	molecular_function	protein binding
F	0005829	cellular_component	cytosol
F	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
F	0009234	biological_process	menaquinone biosynthetic process
F	0016829	molecular_function	lyase activity
F	0071890	molecular_function	bicarbonate binding
G	0003824	molecular_function	catalytic activity
G	0005515	molecular_function	protein binding
G	0005829	cellular_component	cytosol
G	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
G	0009234	biological_process	menaquinone biosynthetic process
G	0016829	molecular_function	lyase activity
G	0071890	molecular_function	bicarbonate binding
H	0003824	molecular_function	catalytic activity
H	0005515	molecular_function	protein binding
H	0005829	cellular_component	cytosol
H	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
H	0009234	biological_process	menaquinone biosynthetic process
H	0016829	molecular_function	lyase activity
H	0071890	molecular_function	bicarbonate binding
I	0003824	molecular_function	catalytic activity
I	0005515	molecular_function	protein binding
I	0005829	cellular_component	cytosol
I	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
I	0009234	biological_process	menaquinone biosynthetic process
I	0016829	molecular_function	lyase activity
I	0071890	molecular_function	bicarbonate binding
J	0003824	molecular_function	catalytic activity
J	0005515	molecular_function	protein binding
J	0005829	cellular_component	cytosol
J	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
J	0009234	biological_process	menaquinone biosynthetic process
J	0016829	molecular_function	lyase activity
J	0071890	molecular_function	bicarbonate binding
K	0003824	molecular_function	catalytic activity
K	0005515	molecular_function	protein binding
K	0005829	cellular_component	cytosol
K	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
K	0009234	biological_process	menaquinone biosynthetic process
K	0016829	molecular_function	lyase activity
K	0071890	molecular_function	bicarbonate binding
L	0003824	molecular_function	catalytic activity
L	0005515	molecular_function	protein binding
L	0005829	cellular_component	cytosol
L	0008935	molecular_function	1,4-dihydroxy-2-naphthoyl-CoA synthase activity
L	0009234	biological_process	menaquinone biosynthetic process
L	0016829	molecular_function	lyase activity
L	0071890	molecular_function	bicarbonate binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	28
Details	BINDING SITE FOR RESIDUE 1HA A 301

Chain	Residue
A	GLN43
A	LYS89
A	TYR97
A	VAL108
A	TYR129
A	GLY133
A	THR155
A	SER161
A	PHE162
A	GLN189
A	HOH470
A	VAL44
A	HOH500
A	HOH548
A	HOH561
A	HOH574
A	HOH602
A	HOH606
F	THR254
F	PHE270
F	LYS273
A	ARG45
A	ALA47
A	SER84
A	GLY85
A	GLY86
A	ASP87
A	GLN88

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO A 302

Chain	Residue
A	ASN149
A	HOH488
A	HOH503
J	ASP148
J	ASN149

site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 303

Chain	Residue
A	GLY92
A	ASP93
A	TYR94
A	LYS98
A	HIS104
A	HOH524

site_id	AC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CL A 304

Chain	Residue
A	GLY132
A	GLN154
A	THR155
A	GLY156
A	TRP184
A	HOH500
A	HOH561

site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL A 305

Chain	Residue
A	ARG45
A	LYS80
A	HOH476

site_id	AC6
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL A 306

Chain	Residue
C	BTB310

site_id	AC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE BCT A 307

Chain	Residue
A	ARG26
A	GLY78
A	HOH484

site_id	AC8
Number of Residues	30
Details	BINDING SITE FOR RESIDUE 1HA B 301

Chain	Residue
B	GLN43
B	VAL44
B	ARG45
B	SER84
B	GLY85
B	GLY86
B	ASP87
B	GLN88
B	LYS89
B	TYR97
B	VAL108
B	LEU109
B	TYR129
B	GLY133
B	THR155
B	VAL159
B	SER161
B	PHE162
B	GLN189
B	HOH472
B	HOH502
B	HOH513
B	HOH549
B	HOH566
D	THR254
D	PHE270
D	LYS273
D	HOH506
F	MET1
F	HOH540

site_id	AC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 302

Chain	Residue
B	THR203
B	GLU213
B	ARG216
B	TRP217
B	HOH458
E	ARG188

site_id	BC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PEG B 303

Chain	Residue
B	HIS105
B	ASN107
B	HOH504
B	HOH506
B	HOH557
D	TYR65

site_id	BC2
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO B 304

Chain	Residue
B	ARG283
C	LYS89

site_id	BC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 B 305

Chain	Residue
B	TYR94
B	LYS98
B	HIS104
B	HOH507
B	GLY92
B	ASP93

site_id	BC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 B 306

Chain	Residue
B	LYS98
J	ARG26
J	ASN40
J	HOH581

site_id	BC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL B 307

Chain	Residue
B	GLY132
B	GLN154
B	THR155
B	GLY156
B	TRP184
B	HOH566

site_id	BC6
Number of Residues	37
Details	BINDING SITE FOR RESIDUE 1HA C 301

Chain	Residue
A	MET1
B	LYS282
C	GLN43
C	VAL44
C	ARG45
C	ALA47
C	ASP67
C	SER84
C	GLY85
C	GLY86
C	ASP87
C	GLN88
C	TYR97
C	VAL108
C	LEU109
C	TYR129
C	GLY133
C	THR155
C	VAL159
C	SER161
C	PHE162
C	GLN189
C	HOH483
C	HOH520
C	HOH526
C	HOH552
C	HOH568
C	HOH582
C	HOH613
C	HOH624
C	HOH630
C	HOH643
C	HOH647
E	THR254
E	PHE270
E	LYS273
E	HOH558

site_id	BC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL C 302

Chain	Residue
C	ASP79
C	LYS80
C	GLY128
C	TYR129
C	ASN149
C	HOH596

site_id	BC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL C 303

Chain	Residue
C	THR203
C	GLU213
C	ARG216
C	TRP217
C	HOH515
D	ARG188

site_id	BC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PEG C 304

Chain	Residue
C	LYS54
C	ASP99
C	HIS105
C	HOH443
C	HOH654

site_id	CC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO C 305

Chain	Residue
C	GLN58
C	HOH475
C	HOH579

site_id	CC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO C 306

Chain	Residue
C	LEU196
C	ASP197
C	BTB310
D	ASP197

site_id	CC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO C 307

Chain	Residue
C	GLU20
C	GLY21
C	GLN58

site_id	CC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 C 308

Chain	Residue
C	GLU14
C	GLY92
C	ASP93
C	TYR94
C	LYS98
C	HIS104
C	HOH407

site_id	CC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL C 309

Chain	Residue
C	GLY132
C	GLN154
C	THR155
C	GLY156
C	TRP184
C	HOH483

site_id	CC6
Number of Residues	13
Details	BINDING SITE FOR RESIDUE BTB C 310

Chain	Residue
A	ILE174
A	VAL175
A	LYS179
A	MET198
A	CL306
C	ILE174
C	VAL175
C	MET198
C	EDO306
C	HOH439
C	HOH573
D	ILE174
D	MET198

site_id	CC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL D 301

Chain	Residue
A	ARG188
D	THR203
D	VAL205
D	GLU213
D	ARG216
D	TRP217
D	HOH465
D	HOH507

site_id	CC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL D 302

Chain	Residue
D	LYS80
D	TYR129
D	ASN149
D	HOH440

site_id	CC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL D 303

Chain	Residue
D	GLN194
D	HOH434
D	HOH455

site_id	DC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL D 304

Chain	Residue
D	ARG45
D	TYR129
D	BCT309
D	BCT310
D	HOH537
D	HOH544

site_id	DC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PEG D 305

Chain	Residue
D	VAL44
D	ALA47
D	SER84
D	GLY86
D	GLN88
D	BCT310
D	HOH551

site_id	DC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE EDO D 306

Chain	Residue
D	GLY85
D	GLY86
D	GLY133
D	SO4307
D	BCT308
D	HOH523

site_id	DC4
Number of Residues	10
Details	BINDING SITE FOR RESIDUE SO4 D 307

Chain	Residue
D	GLY132
D	GLY133
D	GLN154
D	THR155
D	GLY156
D	PHE162
D	TRP184
D	EDO306
D	BCT308
D	HOH523

site_id	DC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE BCT D 308

Chain	Residue
D	SER161
D	EDO306
D	SO4307
D	HOH422
D	HOH523

site_id	DC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE BCT D 309

Chain	Residue
D	GOL304
D	HOH537
D	HOH544

site_id	DC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE BCT D 310

Chain	Residue
D	GOL304
D	PEG305
D	HOH551

site_id	DC8
Number of Residues	30
Details	BINDING SITE FOR RESIDUE 1HA E 301

Chain	Residue
B	ILE2
C	THR254
C	PHE270
C	LYS273
E	GLN43
E	VAL44
E	ARG45
E	ALA47
E	SER84
E	GLY85
E	GLY86
E	ASP87
E	GLN88
E	LYS89
E	TYR97
E	VAL108
E	TYR129
E	GLY133
E	THR155
E	VAL159
E	SER161
E	PHE162
E	GLN189
E	HOH505
E	HOH511
E	HOH557
E	HOH559
E	HOH584
I	GLY21
I	GLU23

site_id	DC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL E 302

Chain	Residue
E	THR203
E	VAL205
E	GLU213
E	ARG216
E	TRP217
E	HOH563
F	ARG188

site_id	EC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL E 303

Chain	Residue
A	HOH490
C	LEU109
C	HOH590
E	ARG230
E	GLU248
E	ASN252
E	MET255
E	HOH467
E	HOH496

site_id	EC2
Number of Residues	1
Details	BINDING SITE FOR RESIDUE PEG E 304

Chain	Residue
E	ASN107

site_id	EC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO E 305

Chain	Residue
E	ARG26
E	GLY78
E	HOH427
E	HOH533

site_id	EC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO E 306

Chain	Residue
E	LYS80
E	TYR129
E	ASN149
E	ILE151
E	HOH585

site_id	EC5
Number of Residues	1
Details	BINDING SITE FOR RESIDUE EDO E 307

Chain	Residue
E	GLU20

site_id	EC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 E 308

Chain	Residue
E	GLY92
E	ASP93
E	TYR94
E	HIS104

site_id	EC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 E 309

Chain	Residue
B	ALA172
B	GLY176
E	ALA172
E	GLY176
F	ALA172
F	GLY176
F	BTB308

site_id	EC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CL E 310

Chain	Residue
E	GLY132
E	GLN154
E	THR155
E	GLY156
E	TRP184
E	HOH505
E	HOH557

site_id	EC9
Number of Residues	27
Details	BINDING SITE FOR RESIDUE 1HA F 301

Chain	Residue
A	THR254
A	PHE270
A	LYS273
E	MET1
E	HOH560
F	GLN43
F	VAL44
F	ARG45
F	SER84
F	GLY85
F	GLY86
F	ASP87
F	GLN88
F	LYS89
F	TYR97
F	VAL108
F	TYR129
F	GLY133
F	THR155
F	VAL159
F	SER161
F	PHE162
F	GLN189
F	HOH547
F	HOH550
F	HOH576
F	HOH587

site_id	FC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL F 302

Chain	Residue
F	LYS80
F	TYR129
F	ASN149
F	HOH481
L	ASP148
L	GOL302

site_id	FC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PEG F 303

Chain	Residue
A	TYR65
F	ASP99
F	HIS105
F	HOH458
F	HOH558

site_id	FC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PEG F 304

Chain	Residue
A	HIS105
F	TYR65
F	HOH581

site_id	FC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 F 305

Chain	Residue
F	GLY92
F	ASP93
F	TYR94
F	LYS98
F	HIS104
F	HOH523
F	HOH583

site_id	FC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL F 306

Chain	Residue
F	GLY132
F	GLN154
F	THR155
F	GLY156
F	TRP184
F	HOH547

site_id	FC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL F 307

Chain	Residue
F	ARG26
F	GLY78
F	HOH575

site_id	FC7
Number of Residues	12
Details	BINDING SITE FOR RESIDUE BTB F 308

Chain	Residue
B	ILE174
E	ILE174
E	ASP197
E	MET198
E	SO4309
F	ILE174
F	VAL175
F	LYS179
F	ASP197
F	MET198
F	HOH552
F	HOH557

site_id	FC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE BCT F 309

Chain	Residue
D	ASN68
F	ARG283

site_id	FC9
Number of Residues	28
Details	BINDING SITE FOR RESIDUE 1HA G 301

Chain	Residue
G	GLN43
G	VAL44
G	ARG45
G	ALA47
G	SER84
G	GLY85
G	GLY86
G	ASP87
G	GLN88
G	TYR97
G	VAL108
G	LEU109
G	TYR129
G	GLY133
G	THR155
G	VAL159
G	SER161
G	PHE162
G	GLN189
G	HOH541
G	HOH555
G	HOH580
J	MET1
J	HOH570
L	THR254
L	PHE270
L	LYS273
L	HOH606

site_id	GC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL G 302

Chain	Residue
G	ARG173
G	ASP239
G	CYS240
G	HOH496
G	HOH497
I	ARG173

site_id	GC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL G 303

Chain	Residue
G	THR203
G	VAL205
G	GLU213
G	ARG216
G	TRP217
G	HOH435
I	ARG188

site_id	GC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO G 304

Chain	Residue
G	ALA77
G	GLY78
G	HOH499

site_id	GC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO G 305

Chain	Residue
G	LYS54
G	ASP99
G	HIS105

site_id	GC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO G 306

Chain	Residue
G	ARG283
K	ASN68

site_id	GC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 G 307

Chain	Residue
G	GLY92
G	ASP93
G	TYR94
G	LYS98
G	HIS104

site_id	GC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL G 308

Chain	Residue
G	GLY132
G	GLN154
G	THR155
G	GLY156
G	TRP184
G	HOH555

site_id	GC8
Number of Residues	30
Details	BINDING SITE FOR RESIDUE 1HA H 301

Chain	Residue
H	GLN43
H	VAL44
H	ARG45
H	SER84
H	GLY85
H	GLY86
H	ASP87
H	GLN88
H	LYS89
H	TYR97
H	VAL108
H	LEU109
H	TYR129
H	GLY133
H	THR155
H	VAL159
H	SER161
H	PHE162
H	GLN189
H	HOH427
H	HOH475
H	HOH513
H	HOH525
H	HOH530
H	HOH588
J	THR254
J	PHE270
J	LYS273
J	HOH535
L	MET1

site_id	GC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL H 302

Chain	Residue
H	ILE174
H	MET198
K	ILE174
K	MET198

site_id	HC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL H 303

Chain	Residue
H	THR203
H	VAL205
H	GLU213
H	ARG216
H	TRP217
H	HOH508
K	ARG188

site_id	HC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PEG H 304

Chain	Residue
H	LYS54
H	ASP99
H	HIS105
H	HOH561

site_id	HC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO H 305

Chain	Residue
H	ASP197
H	HOH479
H	HOH496
H	HOH526
K	ASP197

site_id	HC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO H 306

Chain	Residue
H	LYS80
H	GLY128
H	TYR129
H	ASN149
H	HOH552

site_id	HC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 H 307

Chain	Residue
H	GLY92
H	ASP93
H	TYR94
H	LYS98
H	HIS104

site_id	HC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 H 308

Chain	Residue
H	ALA172
H	GLY176
K	ALA172
K	GLY176
L	ALA172
L	GLY176

site_id	HC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CL H 309

Chain	Residue
H	GLY132
H	GLN154
H	THR155
H	GLY156
H	TRP184
H	HOH427
H	HOH530

site_id	HC8
Number of Residues	30
Details	BINDING SITE FOR RESIDUE 1HA I 301

Chain	Residue
G	MET1
I	GLN43
I	VAL44
I	ARG45
I	ALA47
I	SER84
I	GLY85
I	GLY86
I	ASP87
I	GLN88
I	LYS89
I	TYR97
I	VAL108
I	LEU109
I	TYR129
I	GLY133
I	THR155
I	SER161
I	PHE162
I	GLN189
I	HOH474
I	HOH477
I	HOH489
I	HOH586
K	THR254
K	PHE270
K	LYS273
K	HOH467
K	HOH503
K	HOH532

site_id	HC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL I 302

Chain	Residue
C	ASP148
C	ASN149
I	LYS80
I	ASN149
I	GOL303
I	HOH449

site_id	IC1
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL I 303

Chain	Residue
C	ASP148
I	LYS80
I	GLY128
I	TYR129
I	ASN149
I	ILE151
I	GOL302
I	HOH516
I	HOH532

site_id	IC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PEG I 304

Chain	Residue
I	ASP99
I	ASN107
I	HOH515
I	HOH543

site_id	IC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO I 305

Chain	Residue
I	ARG45
I	LYS80
I	HOH529
I	HOH580

site_id	IC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 I 306

Chain	Residue
I	GLY92
I	ASP93
I	TYR94
I	LYS98
I	HIS104
I	HOH538
I	HOH571

site_id	IC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL I 307

Chain	Residue
I	GLY132
I	GLN154
I	THR155
I	GLY156
I	TRP184
I	HOH474

site_id	IC6
Number of Residues	11
Details	BINDING SITE FOR RESIDUE BTB I 309

Chain	Residue
G	ILE174
G	VAL175
G	ASP197
I	ILE174
I	VAL175
I	ASP197
I	MET198
I	HOH572
J	ILE174
J	MET198
J	GOL302

site_id	IC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE BCT I 310

Chain	Residue
I	ARG26
I	ALA77
I	GLY78

site_id	IC8
Number of Residues	25
Details	BINDING SITE FOR RESIDUE 1HA J 301

Chain	Residue
H	THR254
H	PHE270
H	LYS273
H	HOH503
I	MET1
J	GLN43
J	VAL44
J	ARG45
J	ALA47
J	SER84
J	GLY85
J	GLY86
J	ASP87
J	GLN88
J	VAL108
J	LEU109
J	TYR129
J	GLY133
J	THR155
J	VAL159
J	SER161
J	PHE162
J	GLN189
J	HOH518
J	HOH584

site_id	IC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE GOL J 302

Chain	Residue
G	ASP197
I	BTB309
J	LEU196
J	ASP197
J	GLY199
J	HOH499
J	HOH508

site_id	JC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL J 303

Chain	Residue
J	LYS80
J	TYR129
J	ASN149
J	ILE151
J	HOH512
J	HOH560

site_id	JC2
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL J 304

Chain	Residue
G	ARG188
J	THR203
J	VAL205
J	GLU213
J	ARG216
J	TRP217
J	HOH448
J	HOH557

site_id	JC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL J 305

Chain	Residue
J	GLY132
J	GLN154
J	THR155
J	GLY156
J	TRP184
J	HOH518

site_id	JC4
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL J 306

Chain	Residue
J	HIS104

site_id	JC5
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL J 307

Chain	Residue
J	HOH468

site_id	JC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE BCT J 308

Chain	Residue
J	ARG26
J	ALA77
J	GLY78
J	HOH464

site_id	JC7
Number of Residues	26
Details	BINDING SITE FOR RESIDUE 1HA K 301

Chain	Residue
I	THR254
I	PHE270
I	LYS273
K	GLN43
K	VAL44
K	ARG45
K	ALA47
K	SER84
K	GLY85
K	GLY86
K	ASP87
K	GLN88
K	LYS89
K	TYR97
K	VAL108
K	LEU109
K	TYR129
K	GLY133
K	THR155
K	VAL159
K	SER161
K	PHE162
K	GLN189
K	HOH472
K	HOH537
K	HOH538

site_id	JC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL K 302

Chain	Residue
B	ASP148
B	ASN149
B	HOH523
K	ASN149
K	LEU207
K	HOH445

site_id	JC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PEG K 303

Chain	Residue
I	TYR65
K	LYS54
K	HIS105

site_id	KC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL K 304

Chain	Residue
K	ASP93
K	HIS104

site_id	KC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL K 305

Chain	Residue
K	GLY132
K	GLN154
K	THR155
K	GLY156
K	TRP184
K	HOH537

site_id	KC3
Number of Residues	30
Details	BINDING SITE FOR RESIDUE 1HA L 301

Chain	Residue
G	THR254
G	PHE270
G	LYS273
G	HOH551
K	MET1
L	GLN43
L	VAL44
L	ARG45
L	ALA47
L	SER84
L	GLY85
L	GLY86
L	ASP87
L	GLN88
L	LYS89
L	TYR97
L	VAL108
L	TYR129
L	GLY133
L	THR155
L	VAL159
L	SER161
L	PHE162
L	GLN189
L	HOH466
L	HOH495
L	HOH519
L	HOH545
L	HOH555
L	HOH556

site_id	KC4
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL L 302

Chain	Residue
F	ASN149
F	LEU207
F	GOL302
L	ASP148
L	ASN149
L	HOH459
L	HOH553
L	HOH612

site_id	KC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PEG L 303

Chain	Residue
L	ASP99
L	HIS105

site_id	KC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO L 304

Chain	Residue
L	LYS80
L	TYR129
L	ASN149
L	EDO307
L	HOH554

site_id	KC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE EDO L 305

Chain	Residue
F	ALA208
K	TYR3
L	ARG188
L	GLN189
L	HOH415
L	HOH557

site_id	KC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 L 306

Chain	Residue
L	GLY92
L	ASP93
L	TYR94
L	LYS98
L	HIS104
L	HOH501

site_id	KC9
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO L 307

Chain	Residue
L	ASN149
L	EDO304

site_id	LC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CL L 308

Chain	Residue
L	GLY132
L	GLN154
L	THR155
L	GLY156
L	TRP184
L	HOH495

site_id	LC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE CL L 309

Chain	Residue
H	ARG188
H	HOH472
L	GLU213
L	TRP217
L	HOH518

Functional Information from PROSITE/UniProt

site_id	PS00166
Number of Residues	21
Details	ENOYL_COA_HYDRATASE Enoyl-CoA hydratase/isomerase signature. VAmVAGysiGGGhvlhMmCDL

Chain	Residue	Details
A	VAL123-LEU143

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	72
Details	Binding site: {"description":"in other chain","evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"23658663","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	60
Details	Binding site: {"description":"in other chain","evidences":[{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"23658663","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	11
Details	Binding site: {"description":"in other chain","evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	24
Details	Binding site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"22606952","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI5
Number of Residues	12
Details	Binding site: {"description":"in other chain","evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"23658663","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI6
Number of Residues	12
Details	Binding site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI7
Number of Residues	12
Details	Binding site: {"evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"23658663","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI8
Number of Residues	23
Details	Site: {"description":"Important for catalysis","evidences":[{"source":"HAMAP-Rule","id":"MF_01934","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"21830810","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

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