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4D46

Crystal structure of E. coli FabI in complex with NAD and 5-bromo-2-(4-chloro-2-hydroxyphenoxy)benzonitrile

Functional Information from GO Data
ChainGOidnamespacecontents
A0004318molecular_functionenoyl-[acyl-carrier-protein] reductase (NADH) activity
A0006633biological_processfatty acid biosynthetic process
B0004318molecular_functionenoyl-[acyl-carrier-protein] reductase (NADH) activity
B0006633biological_processfatty acid biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues26
DetailsBINDING SITE FOR RESIDUE NAD A 1258
ChainResidue
AGLY13
AVAL65
ASER91
AILE92
ALEU144
ASER145
ALYS163
AALA189
AGLY190
APRO191
AILE192
AVAL14
AJ471259
AHOH2009
AHOH2010
AHOH2012
AHOH2014
AHOH2083
AHOH2156
AALA15
ASER19
AILE20
AGLN40
ALEU44
ACYS63
AASP64

site_idAC2
Number of Residues25
DetailsBINDING SITE FOR RESIDUE NAD B 1257
ChainResidue
BGLY13
BALA15
BSER19
BILE20
BGLN40
BCYS63
BASP64
BVAL65
BSER91
BILE92
BLEU144
BSER145
BLYS163
BALA189
BGLY190
BPRO191
BILE192
BTHR194
BLEU195
BALA196
BJ471258
BHOH2006
BHOH2007
BHOH2016
BHOH2037

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE J47 A 1259
ChainResidue
AGLY93
AALA95
ALEU100
ATYR146
ATYR156
ANAD1258

site_idAC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE J47 B 1258
ChainResidue
BGLY93
BALA95
BLEU100
BTYR146
BTYR156
BALA196
BNAD1257

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PDB entries from 2024-04-24

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