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3MJS

Structure of A-type Ketoreductases from Modular Polyketide Synthase

Functional Information from PDB Data
site_idAC1
Number of Residues32
DetailsBINDING SITE FOR RESIDUE NDP A 476
ChainResidue
AGLY225
AASP279
AALA280
ASER305
AALA306
AGLY307
ALYS330
ASER353
ATYR367
ATRP393
AGLY394
ATHR227
ATHR395
ATRP396
AGLY400
AMET401
ALMR477
AHOH487
AHOH516
AHOH543
AHOH550
AHOH562
AGLY228
AHOH624
AHOH712
AHOH719
AGLY229
AILE230
ASER250
AARG251
AARG252
ACYS278

site_idAC2
Number of Residues11
DetailsBINDING SITE FOR RESIDUE LMR A 477
ChainResidue
AALA309
ASER354
AGLN364
ATYR367
AGLY394
AMET401
AVAL407
ALEU411
ANDP476
AHOH499
AHOH542

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MLT A 478
ChainResidue
AGLY360
AGLY362
AGLN414
APHE453
AHOH508

site_idAC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 479
ChainResidue
AARG214
APRO215
APRO216
AVAL217
AGLN241
AGLU433
BVAL217

site_idAC5
Number of Residues30
DetailsBINDING SITE FOR RESIDUE NDP B 476
ChainResidue
BGLY225
BTHR227
BGLY228
BGLY229
BILE230
BSER250
BARG251
BARG252
BASP279
BALA280
BSER305
BALA306
BGLY307
BLYS330
BSER353
BTYR367
BTRP393
BGLY394
BTHR395
BTRP396
BGLY400
BMET401
BMLT477
BHOH507
BHOH534
BHOH555
BHOH560
BHOH564
BHOH612
BHOH666

site_idAC6
Number of Residues10
DetailsBINDING SITE FOR RESIDUE MLT B 477
ChainResidue
BALA309
BSER354
BGLN364
BTYR367
BMET401
BVAL407
BLEU411
BNDP476
BHOH498
BHOH541

site_idAC7
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MLT B 478
ChainResidue
BALA452
BPHE453
BHOH719
BGLY360
BSER361
BGLY362
BGLN414

site_idAC8
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL B 479
ChainResidue
BARG214
BARG237
BLEU238
BGLN241
BLEU425
BLEU428
BASP429

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PDB entries from 2024-07-17

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