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4PXL

Structure of Zm ALDH2-3 (RF2C) in complex with NAD

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0016491molecular_functionoxidoreductase activity
A0016620molecular_functionoxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
B0000166molecular_functionnucleotide binding
B0016491molecular_functionoxidoreductase activity
B0016620molecular_functionoxidoreductase activity, acting on the aldehyde or oxo group of donors, NAD or NADP as acceptor
Functional Information from PDB Data
site_idAC1
Number of Residues27
DetailsBINDING SITE FOR RESIDUE NAD A 601
ChainResidue
AILE166
AGLY230
AALA231
APHE244
ATHR245
AGLY246
ASER247
AVAL250
AGLU269
ALEU270
AGLY271
AVAL167
ACSO303
AGLN350
ALYS353
AGLU400
APHE402
ACA611
AHOH724
AHOH803
APRO168
ATRP169
AASN170
ALYS193
AALA195
AGLU196
AGLY226

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EDO A 602
ChainResidue
AVAL332
AGLY376

site_idAC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE PEG A 603
ChainResidue
AGLU325
ALYS329
BTYR357
BILE360

site_idAC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE EDO A 604
ChainResidue
AGLY272
ALYS273
ASER274
APRO275
ATYR426
AGLY427
ALEU428
AALA429

site_idAC5
Number of Residues2
DetailsBINDING SITE FOR RESIDUE PEG A 605
ChainResidue
AASN436
AASP438

site_idAC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE EDO A 606
ChainResidue
ATHR144
ALEU145
ALYS146
AHOH729
BVAL140
BGLY142
BTHR155
BLEU156
BLYS157

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE PEG A 607
ChainResidue
BPHE279
BASP281
BGLN312
BVAL414
BVAL439

site_idAC8
Number of Residues5
DetailsBINDING SITE FOR RESIDUE NA A 609
ChainResidue
ATHR41
AARG42
AASP110
AGLN197
AHOH829

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE PEG A 610
ChainResidue
ATYR171
ATHR174
APHE458
APHE460
AHOH821

site_idBC1
Number of Residues1
DetailsBINDING SITE FOR RESIDUE CA A 611
ChainResidue
ANAD601

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE EDO A 612
ChainResidue
ATHR248
AGLU249
AARG252
AARG425
AMET471

site_idBC3
Number of Residues25
DetailsBINDING SITE FOR RESIDUE NAD B 601
ChainResidue
BILE166
BVAL167
BPRO168
BTRP169
BASN170
BLYS193
BALA195
BGLU196
BGLY226
BGLY230
BALA231
BPHE244
BTHR245
BGLY246
BSER247
BVAL250
BLEU253
BGLU269
BLEU270
BGLY271
BCYS303
BGLN350
BLYS353
BGLU400
BPHE402

site_idBC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE EDO B 602
ChainResidue
BASN441
BTHR442
BPRO495
BLEU496
BTYR497
BASP438

site_idBC5
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EDO B 603
ChainResidue
BASP438
BTYR497

site_idBC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE NA B 604
ChainResidue
BTHR41
BARG42
BASP110
BGLN197
BHOH812

site_idBC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO B 605
ChainResidue
AASN498
ATHR499
APRO500
BARG79

site_idBC8
Number of Residues2
DetailsBINDING SITE FOR RESIDUE EDO B 606
ChainResidue
BGLU260
BSER261

Functional Information from PROSITE/UniProt
site_idPS00070
Number of Residues12
DetailsALDEHYDE_DEHYDR_CYS Aldehyde dehydrogenases cysteine active site. YtNKGEICVAGT
ChainResidueDetails
ATYR296-THR307
BTYR296-THR307

site_idPS00687
Number of Residues8
DetailsALDEHYDE_DEHYDR_GLU Aldehyde dehydrogenases glutamic acid active site. LELGGKSP
ChainResidueDetails
ALEU268-PRO275
BLEU268-PRO275

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PDB entries from 2024-10-09

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