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6UJK

Crystal Structure of a Probable short-chain type dehydrogenase/reductase (Rv1144) from Mycobacterium tuberculosis with bound NAD

Functional Information from GO Data
ChainGOidnamespacecontents
A0005886cellular_componentplasma membrane
A0009274cellular_componentpeptidoglycan-based cell wall
A0016491molecular_functionoxidoreductase activity
B0005886cellular_componentplasma membrane
B0009274cellular_componentpeptidoglycan-based cell wall
B0016491molecular_functionoxidoreductase activity
Functional Information from PDB Data
site_idAC1
Number of Residues31
Detailsbinding site for residue NAD A 301
ChainResidue
AGLY12
ACYS82
AALA83
AGLY84
ATHR141
AALA142
ASER143
ATYR156
ALYS160
APRO186
AGLY187
ASER15
APHE189
ATHR191
APRO192
ALEU193
AHOH432
AHOH453
AHOH455
AHOH480
AHOH485
AHOH486
AGLY16
AHOH522
AHOH525
ALEU17
AASP36
ALEU37
AALA55
AASP56
AVAL57

site_idAC2
Number of Residues6
Detailsbinding site for residue EDO A 302
ChainResidue
AARG104
AARG104
AASP108
AASP108
AHOH567
AHOH567

site_idAC3
Number of Residues7
Detailsbinding site for residue EDO A 303
ChainResidue
AGLN150
AILE245
AARG246
AMET247
AALA248
AHOH434
AHOH495

site_idAC4
Number of Residues3
Detailsbinding site for residue EDO A 304
ChainResidue
AASP5
BALA88
BARG90

site_idAC5
Number of Residues13
Detailsbinding site for residue TRS A 305
ChainResidue
APHE147
AGLU237
AVAL238
AHOH403
AHOH423
AHOH476
AHOH504
AHOH505
AHOH506
AHOH532
BPHE147
BGLU237
BVAL238

site_idAC6
Number of Residues31
Detailsbinding site for residue NAD B 301
ChainResidue
BGLY12
BSER15
BGLY16
BLEU17
BASP36
BLEU37
BALA55
BASP56
BVAL57
BCYS82
BALA83
BGLY84
BTHR141
BALA142
BSER143
BTYR156
BLYS160
BPRO186
BGLY187
BPHE189
BTHR191
BPRO192
BLEU193
BHOH412
BHOH430
BHOH445
BHOH468
BHOH497
BHOH504
BHOH511
BHOH525

site_idAC7
Number of Residues8
Detailsbinding site for residue EDO B 302
ChainResidue
BILE89
BASP95
BGLY96
BVAL97
BPRO99
BHOH472
BHOH507
BHOH544

site_idAC8
Number of Residues6
Detailsbinding site for residue EDO B 303
ChainResidue
BILE245
BARG246
BMET247
BALA248
BHOH469
BHOH517

site_idAC9
Number of Residues6
Detailsbinding site for residue EDO B 304
ChainResidue
BARG104
BARG104
BASP108
BASP108
BHOH531
BHOH531

site_idAD1
Number of Residues4
Detailsbinding site for residue EDO B 305
ChainResidue
BARG77
BGLU134
BGLY136
BVAL137

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. SvaafdgqigQaaYSASKGGVvGMTlPIA
ChainResidueDetails
ASER143-ALA171

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU10001
ChainResidueDetails
ATYR156
BTYR156

site_idSWS_FT_FI2
Number of Residues20
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:Q99714
ChainResidueDetails
BASP36
BASP56
BVAL57
BCYS82
BTYR156
BLYS160
BPHE189
BTHR191
AASP36
AASP56
AVAL57
ACYS82
ATYR156
ALYS160
APHE189
ATHR191
BSER15
BLEU17
ASER15
ALEU17

site_idSWS_FT_FI3
Number of Residues2
DetailsBINDING: BINDING => ECO:0000250
ChainResidueDetails
ASER143
BSER143

219869

PDB entries from 2024-05-15

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