Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

2ONM

Human Mitochondrial Aldehyde Dehydrogenase Asian Variant, ALDH2*2, complexed with NAD+

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
A	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
A	0005739	cellular_component	mitochondrion
A	0005759	cellular_component	mitochondrial matrix
A	0005975	biological_process	carbohydrate metabolic process
A	0006066	biological_process	alcohol metabolic process
A	0006067	biological_process	ethanol metabolic process
A	0006068	biological_process	ethanol catabolic process
A	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
A	0009055	molecular_function	electron transfer activity
A	0016491	molecular_function	oxidoreductase activity
A	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
A	0018937	biological_process	nitroglycerin metabolic process
A	0046185	biological_process	aldehyde catabolic process
A	0051287	molecular_function	NAD binding
A	0070062	cellular_component	extracellular exosome
A	0106435	molecular_function	carboxylesterase activity
A	0110095	biological_process	cellular detoxification of aldehyde
A	1903179	biological_process	regulation of dopamine biosynthetic process
A	1905627	biological_process	regulation of serotonin biosynthetic process
B	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
B	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
B	0005739	cellular_component	mitochondrion
B	0005759	cellular_component	mitochondrial matrix
B	0005975	biological_process	carbohydrate metabolic process
B	0006066	biological_process	alcohol metabolic process
B	0006067	biological_process	ethanol metabolic process
B	0006068	biological_process	ethanol catabolic process
B	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
B	0009055	molecular_function	electron transfer activity
B	0016491	molecular_function	oxidoreductase activity
B	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
B	0018937	biological_process	nitroglycerin metabolic process
B	0046185	biological_process	aldehyde catabolic process
B	0051287	molecular_function	NAD binding
B	0070062	cellular_component	extracellular exosome
B	0106435	molecular_function	carboxylesterase activity
B	0110095	biological_process	cellular detoxification of aldehyde
B	1903179	biological_process	regulation of dopamine biosynthetic process
B	1905627	biological_process	regulation of serotonin biosynthetic process
C	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
C	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
C	0005739	cellular_component	mitochondrion
C	0005759	cellular_component	mitochondrial matrix
C	0005975	biological_process	carbohydrate metabolic process
C	0006066	biological_process	alcohol metabolic process
C	0006067	biological_process	ethanol metabolic process
C	0006068	biological_process	ethanol catabolic process
C	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
C	0009055	molecular_function	electron transfer activity
C	0016491	molecular_function	oxidoreductase activity
C	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
C	0018937	biological_process	nitroglycerin metabolic process
C	0046185	biological_process	aldehyde catabolic process
C	0051287	molecular_function	NAD binding
C	0070062	cellular_component	extracellular exosome
C	0106435	molecular_function	carboxylesterase activity
C	0110095	biological_process	cellular detoxification of aldehyde
C	1903179	biological_process	regulation of dopamine biosynthetic process
C	1905627	biological_process	regulation of serotonin biosynthetic process
D	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
D	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
D	0005739	cellular_component	mitochondrion
D	0005759	cellular_component	mitochondrial matrix
D	0005975	biological_process	carbohydrate metabolic process
D	0006066	biological_process	alcohol metabolic process
D	0006067	biological_process	ethanol metabolic process
D	0006068	biological_process	ethanol catabolic process
D	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
D	0009055	molecular_function	electron transfer activity
D	0016491	molecular_function	oxidoreductase activity
D	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
D	0018937	biological_process	nitroglycerin metabolic process
D	0046185	biological_process	aldehyde catabolic process
D	0051287	molecular_function	NAD binding
D	0070062	cellular_component	extracellular exosome
D	0106435	molecular_function	carboxylesterase activity
D	0110095	biological_process	cellular detoxification of aldehyde
D	1903179	biological_process	regulation of dopamine biosynthetic process
D	1905627	biological_process	regulation of serotonin biosynthetic process
E	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
E	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
E	0005739	cellular_component	mitochondrion
E	0005759	cellular_component	mitochondrial matrix
E	0005975	biological_process	carbohydrate metabolic process
E	0006066	biological_process	alcohol metabolic process
E	0006067	biological_process	ethanol metabolic process
E	0006068	biological_process	ethanol catabolic process
E	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
E	0009055	molecular_function	electron transfer activity
E	0016491	molecular_function	oxidoreductase activity
E	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
E	0018937	biological_process	nitroglycerin metabolic process
E	0046185	biological_process	aldehyde catabolic process
E	0051287	molecular_function	NAD binding
E	0070062	cellular_component	extracellular exosome
E	0106435	molecular_function	carboxylesterase activity
E	0110095	biological_process	cellular detoxification of aldehyde
E	1903179	biological_process	regulation of dopamine biosynthetic process
E	1905627	biological_process	regulation of serotonin biosynthetic process
F	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
F	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
F	0005739	cellular_component	mitochondrion
F	0005759	cellular_component	mitochondrial matrix
F	0005975	biological_process	carbohydrate metabolic process
F	0006066	biological_process	alcohol metabolic process
F	0006067	biological_process	ethanol metabolic process
F	0006068	biological_process	ethanol catabolic process
F	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
F	0009055	molecular_function	electron transfer activity
F	0016491	molecular_function	oxidoreductase activity
F	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
F	0018937	biological_process	nitroglycerin metabolic process
F	0046185	biological_process	aldehyde catabolic process
F	0051287	molecular_function	NAD binding
F	0070062	cellular_component	extracellular exosome
F	0106435	molecular_function	carboxylesterase activity
F	0110095	biological_process	cellular detoxification of aldehyde
F	1903179	biological_process	regulation of dopamine biosynthetic process
F	1905627	biological_process	regulation of serotonin biosynthetic process
G	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
G	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
G	0005739	cellular_component	mitochondrion
G	0005759	cellular_component	mitochondrial matrix
G	0005975	biological_process	carbohydrate metabolic process
G	0006066	biological_process	alcohol metabolic process
G	0006067	biological_process	ethanol metabolic process
G	0006068	biological_process	ethanol catabolic process
G	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
G	0009055	molecular_function	electron transfer activity
G	0016491	molecular_function	oxidoreductase activity
G	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
G	0018937	biological_process	nitroglycerin metabolic process
G	0046185	biological_process	aldehyde catabolic process
G	0051287	molecular_function	NAD binding
G	0070062	cellular_component	extracellular exosome
G	0106435	molecular_function	carboxylesterase activity
G	0110095	biological_process	cellular detoxification of aldehyde
G	1903179	biological_process	regulation of dopamine biosynthetic process
G	1905627	biological_process	regulation of serotonin biosynthetic process
H	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
H	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
H	0005739	cellular_component	mitochondrion
H	0005759	cellular_component	mitochondrial matrix
H	0005975	biological_process	carbohydrate metabolic process
H	0006066	biological_process	alcohol metabolic process
H	0006067	biological_process	ethanol metabolic process
H	0006068	biological_process	ethanol catabolic process
H	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
H	0009055	molecular_function	electron transfer activity
H	0016491	molecular_function	oxidoreductase activity
H	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
H	0018937	biological_process	nitroglycerin metabolic process
H	0046185	biological_process	aldehyde catabolic process
H	0051287	molecular_function	NAD binding
H	0070062	cellular_component	extracellular exosome
H	0106435	molecular_function	carboxylesterase activity
H	0110095	biological_process	cellular detoxification of aldehyde
H	1903179	biological_process	regulation of dopamine biosynthetic process
H	1905627	biological_process	regulation of serotonin biosynthetic process
I	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
I	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
I	0005739	cellular_component	mitochondrion
I	0005759	cellular_component	mitochondrial matrix
I	0005975	biological_process	carbohydrate metabolic process
I	0006066	biological_process	alcohol metabolic process
I	0006067	biological_process	ethanol metabolic process
I	0006068	biological_process	ethanol catabolic process
I	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
I	0009055	molecular_function	electron transfer activity
I	0016491	molecular_function	oxidoreductase activity
I	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
I	0018937	biological_process	nitroglycerin metabolic process
I	0046185	biological_process	aldehyde catabolic process
I	0051287	molecular_function	NAD binding
I	0070062	cellular_component	extracellular exosome
I	0106435	molecular_function	carboxylesterase activity
I	0110095	biological_process	cellular detoxification of aldehyde
I	1903179	biological_process	regulation of dopamine biosynthetic process
I	1905627	biological_process	regulation of serotonin biosynthetic process
J	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
J	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
J	0005739	cellular_component	mitochondrion
J	0005759	cellular_component	mitochondrial matrix
J	0005975	biological_process	carbohydrate metabolic process
J	0006066	biological_process	alcohol metabolic process
J	0006067	biological_process	ethanol metabolic process
J	0006068	biological_process	ethanol catabolic process
J	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
J	0009055	molecular_function	electron transfer activity
J	0016491	molecular_function	oxidoreductase activity
J	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
J	0018937	biological_process	nitroglycerin metabolic process
J	0046185	biological_process	aldehyde catabolic process
J	0051287	molecular_function	NAD binding
J	0070062	cellular_component	extracellular exosome
J	0106435	molecular_function	carboxylesterase activity
J	0110095	biological_process	cellular detoxification of aldehyde
J	1903179	biological_process	regulation of dopamine biosynthetic process
J	1905627	biological_process	regulation of serotonin biosynthetic process
K	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
K	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
K	0005739	cellular_component	mitochondrion
K	0005759	cellular_component	mitochondrial matrix
K	0005975	biological_process	carbohydrate metabolic process
K	0006066	biological_process	alcohol metabolic process
K	0006067	biological_process	ethanol metabolic process
K	0006068	biological_process	ethanol catabolic process
K	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
K	0009055	molecular_function	electron transfer activity
K	0016491	molecular_function	oxidoreductase activity
K	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
K	0018937	biological_process	nitroglycerin metabolic process
K	0046185	biological_process	aldehyde catabolic process
K	0051287	molecular_function	NAD binding
K	0070062	cellular_component	extracellular exosome
K	0106435	molecular_function	carboxylesterase activity
K	0110095	biological_process	cellular detoxification of aldehyde
K	1903179	biological_process	regulation of dopamine biosynthetic process
K	1905627	biological_process	regulation of serotonin biosynthetic process
L	0004029	molecular_function	aldehyde dehydrogenase (NAD+) activity
L	0004030	molecular_function	aldehyde dehydrogenase [NAD(P)+] activity
L	0005739	cellular_component	mitochondrion
L	0005759	cellular_component	mitochondrial matrix
L	0005975	biological_process	carbohydrate metabolic process
L	0006066	biological_process	alcohol metabolic process
L	0006067	biological_process	ethanol metabolic process
L	0006068	biological_process	ethanol catabolic process
L	0008957	molecular_function	phenylacetaldehyde dehydrogenase (NAD+) activity
L	0009055	molecular_function	electron transfer activity
L	0016491	molecular_function	oxidoreductase activity
L	0016620	molecular_function	oxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
L	0018937	biological_process	nitroglycerin metabolic process
L	0046185	biological_process	aldehyde catabolic process
L	0051287	molecular_function	NAD binding
L	0070062	cellular_component	extracellular exosome
L	0106435	molecular_function	carboxylesterase activity
L	0110095	biological_process	cellular detoxification of aldehyde
L	1903179	biological_process	regulation of dopamine biosynthetic process
L	1905627	biological_process	regulation of serotonin biosynthetic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA B 5003

Chain	Residue
B	GLY299
B	PHE401
B	GLY402
B	HOH2286

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA C 5004

Chain	Residue
C	ASN275
C	ALA290
C	GLY305
C	THR308
C	MET405

site_id	AC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE NA F 5007

Chain	Residue
F	GLY299
F	PHE401
F	GLY402

site_id	AC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA G 5008

Chain	Residue
G	ASN275
G	ALA290
G	ALA293
G	GLY305
G	THR308

site_id	AC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA K 5012

Chain	Residue
K	ASN275
K	ALA290
K	ALA293
K	GLY305
K	THR308

site_id	AC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA A 601

Chain	Residue
A	THR39
A	VAL40
A	ASP109
A	GLN196

site_id	AC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA B 602

Chain	Residue
B	THR39
B	VAL40
B	ASP109
B	GLN196
B	HOH2722

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA C 603

Chain	Residue
C	VAL40
C	ASP109
C	GLN196
C	HOH1247

site_id	AC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA D 604

Chain	Residue
D	VAL40
D	ASP109
D	GLN196
D	VAL345

site_id	BC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA E 605

Chain	Residue
E	THR39
E	VAL40
E	ASP109
E	GLN196

site_id	BC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA F 606

Chain	Residue
F	THR39
F	VAL40
F	ASP109
F	GLN196
F	HOH2029

site_id	BC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA G 607

Chain	Residue
G	THR39
G	VAL40
G	ASP109
G	GLN196
G	HOH2330

site_id	BC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA H 608

Chain	Residue
H	THR39
H	VAL40
H	ASP109
H	GLN196
H	HOH1859

site_id	BC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA I 609

Chain	Residue
I	THR39
I	VAL40
I	ASP109
I	GLN196
I	HOH2491

site_id	BC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE NA J 610

Chain	Residue
J	VAL40
J	PRO42
J	ASP109
J	GLN196
J	VAL345

site_id	BC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE NA K 611

Chain	Residue
K	VAL40
K	ASP109
K	GLN196

site_id	BC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE NA L 612

Chain	Residue
L	THR39
L	VAL40
L	ASP109
L	GLN196

site_id	BC9
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP A 501

Chain	Residue
A	ILE165
A	ILE166
A	TRP168
A	LYS192
A	GLU195
A	GLY225
A	GLY229
A	ALA230
A	PHE243
A	THR244
A	GLY245
A	SER246
A	ILE249
A	ILE253

site_id	CC1
Number of Residues	23
Details	BINDING SITE FOR RESIDUE NAD B 502

Chain	Residue
B	ALA230
B	PHE243
B	THR244
B	GLY245
B	SER246
B	ILE249
B	ILE253
B	GLY270
B	CYS302
B	GLN349
B	GLU399
B	PHE401
B	HOH1088
B	ILE165
B	ILE166
B	PRO167
B	TRP168
B	ASN169
B	LYS192
B	GLU195
B	GLN196
B	GLY225
B	GLY229

site_id	CC2
Number of Residues	25
Details	BINDING SITE FOR RESIDUE NAD C 503

Chain	Residue
C	ILE165
C	ILE166
C	PRO167
C	TRP168
C	ASN169
C	LYS192
C	GLU195
C	GLN196
C	GLY225
C	GLY229
C	ALA230
C	PHE243
C	GLY245
C	SER246
C	ILE249
C	ILE253
C	GLU268
C	CYS302
C	GLN349
C	LYS352
C	GLU399
C	PHE401
C	HOH1943
C	HOH2207
C	HOH2848

site_id	CC3
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP D 504

Chain	Residue
D	ILE165
D	ILE166
D	TRP168
D	LYS192
D	GLU195
D	GLN196
D	GLY225
D	GLY229
D	ALA230
D	PHE243
D	GLY245
D	SER246
D	ILE249
D	ILE253

site_id	CC4
Number of Residues	16
Details	BINDING SITE FOR RESIDUE ADP E 505

Chain	Residue
E	ILE165
E	ILE166
E	TRP168
E	LYS192
E	GLU195
E	GLN196
E	GLY225
E	GLY229
E	ALA230
E	PHE243
E	GLY245
E	SER246
E	ILE249
E	ILE253
E	HOH1251
E	HOH1286

site_id	CC5
Number of Residues	28
Details	BINDING SITE FOR RESIDUE NAD F 506

Chain	Residue
F	ILE165
F	ILE166
F	PRO167
F	TRP168
F	ASN169
F	LYS192
F	ALA194
F	GLU195
F	GLN196
F	GLY225
F	GLY229
F	ALA230
F	PHE243
F	GLY245
F	SER246
F	ILE249
F	ILE253
F	GLU268
F	LEU269
F	GLY270
F	CYS302
F	GLN349
F	LYS352
F	GLU399
F	PHE401
F	HOH1015
F	HOH1051
F	HOH1652

site_id	CC6
Number of Residues	22
Details	BINDING SITE FOR RESIDUE NAD G 507

Chain	Residue
G	ILE165
G	ILE166
G	PRO167
G	TRP168
G	ASN169
G	LYS192
G	GLU195
G	GLY225
G	GLY229
G	ALA230
G	PHE243
G	GLY245
G	SER246
G	ILE249
G	ILE253
G	LEU269
G	GLY270
G	CYS302
G	GLN349
G	LYS352
G	GLU399
G	PHE401

site_id	CC7
Number of Residues	22
Details	BINDING SITE FOR RESIDUE NAD H 508

Chain	Residue
H	ILE165
H	ILE166
H	PRO167
H	TRP168
H	ASN169
H	LYS192
H	GLU195
H	GLY225
H	GLY229
H	ALA230
H	PHE243
H	GLY245
H	SER246
H	ILE249
H	ILE253
H	GLY270
H	CYS302
H	GLN349
H	LYS352
H	GLU399
H	PHE401
H	HOH1055

site_id	CC8
Number of Residues	16
Details	BINDING SITE FOR RESIDUE ADP I 509

Chain	Residue
I	ILE165
I	ILE166
I	TRP168
I	LYS192
I	ALA194
I	GLU195
I	GLY225
I	PRO226
I	GLY229
I	ALA230
I	PHE243
I	THR244
I	GLY245
I	SER246
I	ILE249
I	ILE253

site_id	CC9
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP J 510

Chain	Residue
J	ILE165
J	ILE166
J	TRP168
J	LYS192
J	GLU195
J	GLN196
J	GLY225
J	GLY229
J	ALA230
J	PHE243
J	GLY245
J	SER246
J	ILE249
J	ILE253

site_id	DC1
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP K 511

Chain	Residue
K	ILE165
K	ILE166
K	TRP168
K	LYS192
K	GLU195
K	GLY225
K	GLY229
K	ALA230
K	PHE243
K	GLY245
K	SER246
K	ILE249
K	ILE253
K	HOH1244

site_id	DC2
Number of Residues	13
Details	BINDING SITE FOR RESIDUE ADP L 512

Chain	Residue
L	ILE165
L	ILE166
L	TRP168
L	LYS192
L	GLU195
L	GLY225
L	GLY229
L	ALA230
L	PHE243
L	SER246
L	ILE249
L	ILE253
L	HOH2926

site_id	DC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO B 701

Chain	Residue
A	TYR153
A	ARG155
B	ASN440
B	SER443
D	PHE151

site_id	DC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO A 901

Chain	Residue
A	PHE18
A	TYR101
A	TYR203

site_id	DC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO B 802

Chain	Residue
B	GLN14
B	ASN41
B	VAL47
B	ILE48
B	LEU108

site_id	DC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO C 803

Chain	Residue
C	ASN41
C	THR44
C	GLU46
C	LEU108
C	HOH2212

site_id	DC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO B 902

Chain	Residue
B	ASP98
B	TYR101
B	TYR203
H	HOH1184
H	HOH2159

site_id	DC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO C 903

Chain	Residue
C	ASP98
C	TYR101

site_id	DC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO D 704

Chain	Residue
A	PHE151
C	SER443
D	TYR153
D	ARG155

site_id	EC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO D 904

Chain	Residue
D	PHE18
D	TYR101
D	TYR203
D	HOH2884

site_id	EC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO E 705

Chain	Residue
E	TYR153
E	ARG155
F	ASN440
F	SER443
H	PHE151

site_id	EC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO E 805

Chain	Residue
E	ASN41
E	THR44
E	GLU46
E	ILE48

site_id	EC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO E 905

Chain	Residue
E	PHE18
E	TYR101
E	TYR203
E	HOH2787
I	GLN14

site_id	EC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO F 706

Chain	Residue
E	SER443
F	TYR153
F	ARG155
G	PHE151

site_id	EC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE EDO F 806

Chain	Residue
F	GLN14
F	ASN41
F	THR44
F	GLU46
F	LEU108
F	HOH2389

site_id	EC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO F 906

Chain	Residue
F	PHE18
F	TYR101
F	TYR203
F	HOH2346

site_id	EC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO F 707

Chain	Residue
F	PHE151
G	TYR153
G	ARG155
H	ASN440
H	SER443

site_id	EC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO G 807

Chain	Residue
G	ASN41
G	THR44
G	ILE48
G	LEU108
G	HOH2633

site_id	FC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO G 907

Chain	Residue
G	TYR101
G	HOH2909

site_id	FC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO H 708

Chain	Residue
E	PHE151
G	ASN440
G	SER443
H	TYR153
H	ARG155

site_id	FC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO H 808

Chain	Residue
H	ASN41
H	THR44
H	GLU46
H	HOH2123

site_id	FC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE EDO H 908

Chain	Residue
D	LEU367
H	PHE18
H	ASP98
H	TYR101
H	TYR203
H	HOH1772
H	HOH2005

site_id	FC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE EDO I 809

Chain	Residue
I	THR44
I	GLU46

site_id	FC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE EDO I 909

Chain	Residue
I	PHE18
I	TYR101
I	TYR203
I	HOH1775
I	HOH2128

site_id	FC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO K 911

Chain	Residue
K	TYR101
K	TYR203
K	HOH2794

site_id	FC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE EDO L 712

Chain	Residue
K	ASN440
K	SER443
L	TYR153
L	ARG155

site_id	FC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE EDO L 912

Chain	Residue
L	PHE18
L	TYR101
L	TYR203

site_id	GC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GAI A 902

Chain	Residue
A	ILE146
A	ASP147
B	VAL458
B	PHE459

site_id	GC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GAI E 906

Chain	Residue
E	ASP147
E	PHE150
F	PHE459
F	HOH2713

site_id	GC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GAI G 5009

Chain	Residue
G	ILE146
G	ASP147
G	PHE150
G	HOH2440
G	HOH2819
H	PHE459

site_id	GC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GAI H 909

Chain	Residue
G	PHE459
H	ILE146
H	ASP147
H	PHE150
H	HOH2313

site_id	GC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GAI I 910

Chain	Residue
I	ASP147
I	GLY148
I	PHE150

site_id	GC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GAI J 611

Chain	Residue
I	PHE459
J	ILE146
J	ASP147

site_id	GC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GAI D 905

Chain	Residue
A	ASN440
B	VAL493
C	PHE151
D	ASN440
D	HOH2800

site_id	GC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GAI E 907

Chain	Residue
E	ASN440
E	HOH2847
H	ASN440

site_id	GC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GAI G 5010

Chain	Residue
F	ASN440
F	HOH1342
G	ASN440
G	HOH1845

Functional Information from PROSITE/UniProt

site_id	PS00070
Number of Residues	12
Details	ALDEHYDE_DEHYDR_CYS Aldehyde dehydrogenases cysteine active site. FfNQGQCCCAGS

Chain	Residue	Details
A	PHE295-SER306

site_id	PS00687
Number of Residues	8
Details	ALDEHYDE_DEHYDR_GLU Aldehyde dehydrogenases glutamic acid active site. LELGGKSP

Chain	Residue	Details
A	LEU267-PRO274

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	12
Details	Active site: {"description":"Proton acceptor"}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	12
Details	Active site: {"description":"Nucleophile"}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	60
Details	Binding site: {"evidences":[{"evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	12
Details	Site: {"description":"Transition state stabilizer","evidences":[{"source":"UniProtKB","id":"P20000","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

site_id	SWS_FT_FI5
Number of Residues	108
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"UniProtKB","id":"P47738","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

Catalytic Information from CSA

site_id	CSA1
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
A	CYS302
A	GLU268
A	ASN169

site_id	CSA10
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
J	CYS302
J	GLU268
J	ASN169

site_id	CSA11
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
K	CYS302
K	GLU268
K	ASN169

site_id	CSA12
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
L	CYS302
L	GLU268
L	ASN169

site_id	CSA13
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
A	CYS302
A	LYS192
A	GLU268
A	GLU399

site_id	CSA14
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
B	CYS302
B	LYS192
B	GLU268
B	GLU399

site_id	CSA15
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
C	CYS302
C	LYS192
C	GLU268
C	GLU399

site_id	CSA16
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
D	CYS302
D	LYS192
D	GLU268
D	GLU399

site_id	CSA17
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
E	CYS302
E	LYS192
E	GLU268
E	GLU399

site_id	CSA18
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
F	CYS302
F	LYS192
F	GLU268
F	GLU399

site_id	CSA19
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
G	CYS302
G	LYS192
G	GLU268
G	GLU399

site_id	CSA2
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
B	CYS302
B	GLU268
B	ASN169

site_id	CSA20
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
H	CYS302
H	LYS192
H	GLU268
H	GLU399

site_id	CSA21
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
I	CYS302
I	LYS192
I	GLU268
I	GLU399

site_id	CSA22
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
J	CYS302
J	LYS192
J	GLU268
J	GLU399

site_id	CSA23
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
K	CYS302
K	LYS192
K	GLU268
K	GLU399

site_id	CSA24
Number of Residues	4
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
L	CYS302
L	LYS192
L	GLU268
L	GLU399

site_id	CSA3
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
C	CYS302
C	GLU268
C	ASN169

site_id	CSA4
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
D	CYS302
D	GLU268
D	ASN169

site_id	CSA5
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
E	CYS302
E	GLU268
E	ASN169

site_id	CSA6
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
F	CYS302
F	GLU268
F	ASN169

site_id	CSA7
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
G	CYS302
G	GLU268
G	ASN169

site_id	CSA8
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
H	CYS302
H	GLU268
H	ASN169

site_id	CSA9
Number of Residues	3
Details	Annotated By Reference To The Literature 1a4s

Chain	Residue	Details
I	CYS302
I	GLU268
I	ASN169

site_id	MCSA1
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
A	LYS192	electrostatic stabiliser
A	GLU268	electrostatic stabiliser, proton acceptor, proton donor
A	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
A	GLU399	electrostatic stabiliser

site_id	MCSA10
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
J	LYS192	electrostatic stabiliser
J	GLU268	electrostatic stabiliser, proton acceptor, proton donor
J	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
J	GLU399	electrostatic stabiliser

site_id	MCSA11
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
K	LYS192	electrostatic stabiliser
K	GLU268	electrostatic stabiliser, proton acceptor, proton donor
K	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
K	GLU399	electrostatic stabiliser

site_id	MCSA12
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
L	LYS192	electrostatic stabiliser
L	GLU268	electrostatic stabiliser, proton acceptor, proton donor
L	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
L	GLU399	electrostatic stabiliser

site_id	MCSA2
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
B	LYS192	electrostatic stabiliser
B	GLU268	electrostatic stabiliser, proton acceptor, proton donor
B	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
B	GLU399	electrostatic stabiliser

site_id	MCSA3
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
C	LYS192	electrostatic stabiliser
C	GLU268	electrostatic stabiliser, proton acceptor, proton donor
C	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
C	GLU399	electrostatic stabiliser

site_id	MCSA4
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
D	LYS192	electrostatic stabiliser
D	GLU268	electrostatic stabiliser, proton acceptor, proton donor
D	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
D	GLU399	electrostatic stabiliser

site_id	MCSA5
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
E	LYS192	electrostatic stabiliser
E	GLU268	electrostatic stabiliser, proton acceptor, proton donor
E	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
E	GLU399	electrostatic stabiliser

site_id	MCSA6
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
F	LYS192	electrostatic stabiliser
F	GLU268	electrostatic stabiliser, proton acceptor, proton donor
F	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
F	GLU399	electrostatic stabiliser

site_id	MCSA7
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
G	LYS192	electrostatic stabiliser
G	GLU268	electrostatic stabiliser, proton acceptor, proton donor
G	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
G	GLU399	electrostatic stabiliser

site_id	MCSA8
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
H	LYS192	electrostatic stabiliser
H	GLU268	electrostatic stabiliser, proton acceptor, proton donor
H	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
H	GLU399	electrostatic stabiliser

site_id	MCSA9
Number of Residues	4
Details	M-CSA 803

Chain	Residue	Details
I	LYS192	electrostatic stabiliser
I	GLU268	electrostatic stabiliser, proton acceptor, proton donor
I	CYS302	covalently attached, electrostatic stabiliser, nucleofuge, nucleophile, proton acceptor, proton donor
I	GLU399	electrostatic stabiliser

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