Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

4RJK

Acetolactate synthase from Bacillus subtilis bound to LThDP - crystal form II

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000287	molecular_function	magnesium ion binding
A	0003824	molecular_function	catalytic activity
A	0003984	molecular_function	acetolactate synthase activity
A	0030976	molecular_function	thiamine pyrophosphate binding
A	0034077	biological_process	butanediol metabolic process
B	0000287	molecular_function	magnesium ion binding
B	0003824	molecular_function	catalytic activity
B	0003984	molecular_function	acetolactate synthase activity
B	0030976	molecular_function	thiamine pyrophosphate binding
B	0034077	biological_process	butanediol metabolic process
C	0000287	molecular_function	magnesium ion binding
C	0003824	molecular_function	catalytic activity
C	0003984	molecular_function	acetolactate synthase activity
C	0030976	molecular_function	thiamine pyrophosphate binding
C	0034077	biological_process	butanediol metabolic process
D	0000287	molecular_function	magnesium ion binding
D	0003824	molecular_function	catalytic activity
D	0003984	molecular_function	acetolactate synthase activity
D	0030976	molecular_function	thiamine pyrophosphate binding
D	0034077	biological_process	butanediol metabolic process
E	0000287	molecular_function	magnesium ion binding
E	0003824	molecular_function	catalytic activity
E	0003984	molecular_function	acetolactate synthase activity
E	0030976	molecular_function	thiamine pyrophosphate binding
E	0034077	biological_process	butanediol metabolic process
F	0000287	molecular_function	magnesium ion binding
F	0003824	molecular_function	catalytic activity
F	0003984	molecular_function	acetolactate synthase activity
F	0030976	molecular_function	thiamine pyrophosphate binding
F	0034077	biological_process	butanediol metabolic process
G	0000287	molecular_function	magnesium ion binding
G	0003824	molecular_function	catalytic activity
G	0003984	molecular_function	acetolactate synthase activity
G	0030976	molecular_function	thiamine pyrophosphate binding
G	0034077	biological_process	butanediol metabolic process
H	0000287	molecular_function	magnesium ion binding
H	0003824	molecular_function	catalytic activity
H	0003984	molecular_function	acetolactate synthase activity
H	0030976	molecular_function	thiamine pyrophosphate binding
H	0034077	biological_process	butanediol metabolic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	25
Details	BINDING SITE FOR RESIDUE TPP A 601

Chain	Residue
A	ILE398
A	GLY453
A	ASP478
A	THR480
A	TYR481
A	ASP482
A	MET483
A	VAL484
A	TYR547
A	MG602
A	HOH780
A	GLY399
A	HOH791
B	PRO37
B	GLU61
B	PRO87
B	ASN91
B	GLN124
A	SER400
A	HIS401
A	GLN424
A	LEU426
A	GLY450
A	ASP451
A	GLY452

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG A 602

Chain	Residue
A	ASP451
A	ASP478
A	THR480
A	TPP601
A	HOH791

site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 A 603

Chain	Residue
A	ARG73
A	THR75
A	GLY76
A	ARG224
A	PRO225

site_id	AC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 A 604

Chain	Residue
A	ASN386
A	ASP389
A	ASP390
H	ALA203
H	LYS207
H	THR210
H	THR304

site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 A 605

Chain	Residue
A	ASN100
A	THR101
A	GLN163
A	ASP314
A	PG4608
B	ARG121

site_id	AC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 A 606

Chain	Residue
A	HIS391
A	THR393
A	LEU415
A	LYS440
A	GLU443

site_id	AC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 A 607

Chain	Residue
A	ALA161
A	GLY162
A	HOH759
D	GLY162
D	PRO191
D	ILE312

site_id	AC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 A 608

Chain	Residue
A	LEU97
A	ASN100
A	THR101
A	PRO134
A	PG4605
B	ARG121
B	SER125

site_id	AC9
Number of Residues	24
Details	BINDING SITE FOR RESIDUE TPP B 601

Chain	Residue
A	PRO37
A	GLU61
A	PRO87
A	ASN91
A	GLN124
B	ILE398
B	GLY399
B	SER400
B	HIS401
B	GLN424
B	LEU426
B	GLY450
B	ASP451
B	GLY452
B	GLY453
B	ASP478
B	THR480
B	TYR481
B	ASP482
B	MET483
B	VAL484
B	TYR547
B	MG602
B	HOH812

site_id	BC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG B 602

Chain	Residue
B	ASP451
B	ASP478
B	THR480
B	TPP601
B	HOH812

site_id	BC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 B 603

Chain	Residue
B	SER160
B	ARG224
B	HOH800
B	GLY72
B	ARG73
B	GLY76
B	PRO105

site_id	BC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 B 604

Chain	Residue
B	GLY442
B	PRO470
B	ALA535
B	GLU536
C	LYS233
C	GLU337

site_id	BC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PG4 B 605

Chain	Residue
B	SER331
B	ASN334
B	HIS335
C	ASP198

site_id	BC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PG4 B 606

Chain	Residue
B	LEU415
B	VAL439
B	LYS440
B	GLU443

site_id	BC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PG4 B 607

Chain	Residue
B	ALA203
B	LYS207
B	ASP322

site_id	BC7
Number of Residues	25
Details	BINDING SITE FOR RESIDUE TPP C 601

Chain	Residue
C	ILE398
C	GLY399
C	SER400
C	HIS401
C	GLN424
C	LEU426
C	GLY450
C	ASP451
C	GLY452
C	GLY453
C	PHE456
C	ASP478
C	THR480
C	TYR481
C	ASP482
C	MET483
C	VAL484
C	TYR547
C	MG602
C	HOH817
D	PRO37
D	GLU61
D	PRO87
D	ASN91
D	GLN124

site_id	BC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG C 602

Chain	Residue
C	ASP451
C	ASP478
C	THR480
C	TPP601
C	HOH817

site_id	BC9
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PG4 C 603

Chain	Residue
C	LYS207
C	THR304

site_id	CC1
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PG4 C 604

Chain	Residue
C	LEU74
C	HIS391
C	PRO414
C	LEU415
C	THR416
C	VAL439
C	LYS440
C	GLU443

site_id	CC2
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PG4 C 605

Chain	Residue
C	GLY72
C	ARG73
C	THR75
C	GLY76
C	PRO105
C	SER160
C	PRO225
C	HOH807

site_id	CC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 C 606

Chain	Residue
B	LYS233
B	GLU337
C	LYS444
C	ALA535
C	GLU536

site_id	CC4
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PG4 C 607

Chain	Residue
C	ARG121
D	ASN100

site_id	CC5
Number of Residues	23
Details	BINDING SITE FOR RESIDUE TPP D 601

Chain	Residue
C	PRO37
C	GLU61
C	PRO87
C	ASN91
D	ILE398
D	GLY399
D	SER400
D	HIS401
D	GLN424
D	LEU426
D	GLY450
D	ASP451
D	GLY452
D	GLY453
D	ASP478
D	THR480
D	TYR481
D	ASP482
D	MET483
D	VAL484
D	TYR547
D	MG602
D	HOH707

site_id	CC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG D 602

Chain	Residue
D	ASP451
D	ASP478
D	THR480
D	TPP601
D	HOH707

site_id	CC7
Number of Residues	9
Details	BINDING SITE FOR RESIDUE PG4 D 603

Chain	Residue
D	ARG254
D	VAL388
D	ASP389
D	ASP390
D	PG4609
E	ALA203
E	LYS207
E	THR304
E	ASP322

site_id	CC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 D 604

Chain	Residue
D	GLU27
D	HOH760
E	GLY442
E	LYS444
E	PRO470
E	ASN534
E	PG4608

site_id	CC9
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PG4 D 605

Chain	Residue
D	LYS207
D	THR210
D	THR304
H	ASN386
H	ALA387
H	ASP389
H	ASP390
H	ARG530

site_id	DC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PG4 D 606

Chain	Residue
D	LEU74
D	VAL439
D	LYS440
D	GLU443

site_id	DC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 D 607

Chain	Residue
D	GLY72
D	ARG73
D	GLY76
D	SER160
D	ALA164
D	ARG224
D	PRO225

site_id	DC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 D 608

Chain	Residue
D	ASP389
D	GLU443
D	LYS444
E	ARG186
E	ASP322

site_id	DC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 D 609

Chain	Residue
D	ASP390
D	HIS391
D	GLU413
D	PG4603
E	ASP199
E	HOH786

site_id	DC5
Number of Residues	24
Details	BINDING SITE FOR RESIDUE TPP E 601

Chain	Residue
E	ILE398
E	GLY399
E	SER400
E	HIS401
E	GLN424
E	LEU426
E	GLY450
E	ASP451
E	GLY452
E	GLY453
E	ASP478
E	THR480
E	TYR481
E	ASP482
E	MET483
E	VAL484
E	TYR547
E	MG602
E	HOH750
F	PRO37
F	GLU61
F	PRO87
F	ASN91
F	GLN124

site_id	DC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG E 602

Chain	Residue
E	ASP451
E	ASP478
E	THR480
E	TPP601
E	HOH750

site_id	DC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 E 603

Chain	Residue
A	LYS207
A	THR304
A	ASP322
E	ASN386
E	VAL388
E	ASP389
E	ASP390

site_id	DC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PG4 E 604

Chain	Residue
D	GLY442
D	LYS444
D	PRO470
D	ASN534
D	ALA535
D	GLU536
E	GLU27
E	ASN184

site_id	DC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PG4 E 605

Chain	Residue
E	LEU74
E	LEU415
E	VAL439
E	LYS440

site_id	EC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 E 606

Chain	Residue
E	ASN100
E	THR101
E	ASP288
E	ILE290
E	ASP314
F	ARG121

site_id	EC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PG4 E 607

Chain	Residue
E	GLU364
E	LYS382
E	TYR408

site_id	EC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 E 608

Chain	Residue
A	ASP322
D	ARG186
D	PG4604
E	ASP389
E	GLU443
E	LYS444

site_id	EC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 E 609

Chain	Residue
E	GLY72
E	ARG73
E	GLY76
E	PRO105
E	ALA164
E	PRO225
E	HOH800

site_id	EC5
Number of Residues	22
Details	BINDING SITE FOR RESIDUE TPP F 601

Chain	Residue
E	PRO37
E	GLU61
E	ASN91
F	GLY399
F	SER400
F	HIS401
F	GLN424
F	LEU426
F	GLY450
F	ASP451
F	GLY452
F	GLY453
F	ASP478
F	THR480
F	TYR481
F	ASP482
F	MET483
F	VAL484
F	TYR547
F	MG602
F	HOH753
F	HOH819

site_id	EC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG F 602

Chain	Residue
F	ASP451
F	ASP478
F	THR480
F	TPP601
F	HOH819

site_id	EC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE PG4 F 603

Chain	Residue
F	ARG73
F	LEU74
F	THR75
F	GLY76
F	ARG224
F	PRO225
F	PG4606
F	HOH770

site_id	EC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PG4 F 604

Chain	Residue
F	LYS233
F	GLU337
G	ALA535
G	GLU536

site_id	EC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 F 605

Chain	Residue
F	ASN534
F	ALA535
F	GLU536
G	LYS233
G	LYS237
G	GLU337

site_id	FC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 F 606

Chain	Residue
F	THR393
F	LEU415
F	VAL439
F	LYS440
F	PG4603

site_id	FC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE PG4 F 607

Chain	Residue
F	ALA161
F	GLY162
F	PRO191
F	LYS192
F	LEU193
F	ASP328

site_id	FC3
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PG4 F 608

Chain	Residue
F	LYS207
F	ASP322

site_id	FC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PYR F 609

Chain	Residue
E	GLN487
E	LYS491
F	ALA39
F	LYS40
F	GLN173

site_id	FC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PYR F 610

Chain	Residue
F	SER437
F	HOH778

site_id	FC6
Number of Residues	23
Details	BINDING SITE FOR RESIDUE TPP G 601

Chain	Residue
G	ILE398
G	GLY399
G	SER400
G	HIS401
G	GLN424
G	LEU426
G	GLY450
G	ASP451
G	GLY452
G	GLY453
G	ASP478
G	THR480
G	TYR481
G	ASP482
G	MET483
G	VAL484
G	TYR547
G	MG602
G	HOH738
H	PRO37
H	GLU61
H	PRO87
H	ASN91

site_id	FC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG G 602

Chain	Residue
G	ASP451
G	ASP478
G	THR480
G	TPP601
G	HOH738

site_id	FC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PG4 G 603

Chain	Residue
G	ARG73
G	GLY76
G	PRO105
G	SER160
G	ARG224

site_id	FC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PG4 G 604

Chain	Residue
G	LYS207
G	THR304
G	ASP322

site_id	GC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PG4 G 605

Chain	Residue
G	LEU74
G	LEU415
G	LYS440

site_id	GC2
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PG4 G 606

Chain	Residue
G	GLU364
G	TYR408

site_id	GC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE PYR G 607

Chain	Residue
F	ASP527
F	ASN534
G	GLN239
G	ASP258
G	GLN259

site_id	GC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE PYR G 608

Chain	Residue
G	GLY363
G	GLN365
G	ASP549
G	ASN552

site_id	GC5
Number of Residues	22
Details	BINDING SITE FOR RESIDUE TDL H 601

Chain	Residue
G	PRO37
G	GLU61
G	ASN91
G	GLN124
H	ILE398
H	GLY399
H	SER400
H	HIS401
H	GLN424
H	LEU426
H	GLY450
H	ASP451
H	GLY452
H	GLY453
H	ASP478
H	THR480
H	ASP482
H	MET483
H	VAL484
H	TYR547
H	MG602
H	HOH760

site_id	GC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG H 602

Chain	Residue
H	ASP451
H	ASP478
H	THR480
H	TDL601
H	HOH760

site_id	GC7
Number of Residues	2
Details	BINDING SITE FOR RESIDUE PG4 H 603

Chain	Residue
H	ASN100
H	PRO134

site_id	GC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE PG4 H 604

Chain	Residue
H	GLY72
H	ARG73
H	GLY76
H	SER160
H	ALA164
H	ARG224
H	PRO225

site_id	GC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE PYR H 605

Chain	Residue
A	HIS338
H	LYS237
H	GLU337

Functional Information from PROSITE/UniProt

site_id	PS00187
Number of Residues	20
Details	TPP_ENZYMES Thiamine pyrophosphate enzymes signature. IGaslvkPgekvVsVsGDGG

Chain	Residue	Details
A	ILE434-GLY453

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