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1GKL

S954A mutant of the feruloyl esterase module from clostridium thermocellum complexed with ferulic acid

Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD A 3090
ChainResidue
ACYS823
AHIS886
AMET889
AHOH2158
BGLU1017

site_idAC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD A 3091
ChainResidue
AHIS1085
AGLU894
AHIS1076
AGLU1079
AHIS1083

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD A 3092
ChainResidue
AGLU1007
AHOH2259
BHIS1082
BHIS1084
BHOH2356

site_idAC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CD A 3093
ChainResidue
AHIS947
AHIS1080
AHOH2215
AHOH2219
AHOH2326
AHOH2337

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE CD A 3094
ChainResidue
AHIS1081
AHOH2341
AHOH2346
ACD3095

site_idAC6
Number of Residues4
DetailsBINDING SITE FOR RESIDUE CD A 3095
ChainResidue
AHIS1081
AHOH2370
AACT3089
ACD3094

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD B 3090
ChainResidue
AGLU1017
BCYS823
BHIS886
BMET889
BHOH2155

site_idAC8
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD B 3091
ChainResidue
BGLU894
BHIS1076
BGLU1079
BHIS1083
BHIS1085

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD B 3092
ChainResidue
AHIS1082
AHIS1084
AHOH2344
AHOH2357
BGLU1007

site_idBC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CD B 3093
ChainResidue
BHIS947
BHIS1080
BHOH2222
BHOH2223
BHOH2335
BHOH2348

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD B 3094
ChainResidue
BHIS1081
BHOH2353
BHOH2354
BHOH2355
BCD3095

site_idBC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CD B 3095
ChainResidue
BHIS1081
BHOH2353
BHOH2381
BACT3089
BCD3094

site_idBC4
Number of Residues9
DetailsBINDING SITE FOR RESIDUE FER A 3086
ChainResidue
AALA954
ALEU958
AGLY979
AASP980
ATRP982
AALA1020
AHOH2364
AHOH2365
AGOL3087

site_idBC5
Number of Residues12
DetailsBINDING SITE FOR RESIDUE FER B 3086
ChainResidue
BALA954
BLEU958
BGLY979
BASP980
BTRP982
BALA1020
BASN1023
BHOH2374
BHOH2375
BHOH2376
BHOH2377
BGOL3087

site_idBC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE GOL A 3087
ChainResidue
AGLY865
AGLY866
AGLU868
APHE953
AALA954
AHIS1058
AHOH2364
AHOH2366
AFER3086

site_idBC7
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A 3088
ChainResidue
ALYS856
ATYR857
AASN858
AGLU894
APRO895
ATYR932
AHIS1081
AHOH2367

site_idBC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ACT A 3089
ChainResidue
ATYR857
AHIS1081
AHOH2368
AHOH2369
ACD3095
ALYS856

site_idBC9
Number of Residues10
DetailsBINDING SITE FOR RESIDUE GOL B 3087
ChainResidue
BGLY865
BGLY866
BGLU868
BPHE953
BALA954
BHIS1058
BHOH2127
BHOH2374
BHOH2378
BFER3086

site_idCC1
Number of Residues12
DetailsBINDING SITE FOR RESIDUE GOL B 3088
ChainResidue
ASER927
ALYS928
BGLU926
BSER927
BLYS928
BTYR929
BSER930
BHOH2200
BHOH2201
BHOH2203
BHOH2208
BHOH2379

site_idCC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ACT B 3089
ChainResidue
BLYS856
BTYR857
BHIS1081
BHOH2112
BHOH2380
BHOH2381
BCD3095

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PDB entries from 2025-12-17

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