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5AQU

Fragment-based screening of HSP70 sheds light on the functional role of ATP-binding site residues

Functional Information from GO Data
ChainGOidnamespacecontents
A0005524molecular_functionATP binding
A0140662molecular_functionATP-dependent protein folding chaperone
B0051087molecular_functionprotein-folding chaperone binding
Functional Information from PDB Data
site_idAC1
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A 1382
ChainResidue
AASN256
AARG258
AALA259
AARG262
ASER286
ALEU287
AGOL1387
BGLN245

site_idAC2
Number of Residues10
DetailsBINDING SITE FOR RESIDUE GOL B 1261
ChainResidue
BLEU148
BGLY149
BSER150
BASN151
BGLU155
BASN229
BLYS231
BASP232
BHOH2006
BPRO147

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL B 1262
ChainResidue
BGLU166
BLYS236
BGLY239
BLEU240
BLYS243

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A 1383
ChainResidue
AARG299
AGLU303
APRO344
ALYS345

site_idAC5
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 1384
ChainResidue
AARG171
ATHR177
AASP214
AILE216
APHE217
AGLN376
AHOH2090

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL A 1385
ChainResidue
ATHR13
AARG72
AARG76
AVAL82
AASP86
ATYR149

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL B 1263
ChainResidue
AGLU289
AILE291
BTHR253
BASN257

site_idAC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A 1386
ChainResidue
AASP152
AGLN156
AGLU213
AASP214

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 1387
ChainResidue
AASN256
AARG258
AGOL1382
AHOH2112
BGLN245

site_idBC1
Number of Residues11
DetailsBINDING SITE FOR RESIDUE UX0 A 1388
ChainResidue
AGLY202
AGLY230
AGLU268
ALYS271
AARG272
ASER275
AGLY339
ASER340
AARG342
AHOH2099
AHOH2129

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE DMS A 1389
ChainResidue
AGLU27
AILE28
AILE29
AALA30
ATYR134

site_idBC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE TRS A 1390
ChainResidue
AASP10
AGLY12
ALYS71
AGLU175
AASP199
AGLY201
AGLY338
AHOH2011
AHOH2167

site_idBC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG B 1264
ChainResidue
BASP204
BGLU255
BILE258
BCYS259
BHOH2050

Functional Information from PROSITE/UniProt
site_idPS00297
Number of Residues8
DetailsHSP70_1 Heat shock hsp70 proteins family signature 1. IDLGTTyS
ChainResidueDetails
AILE9-SER16

site_idPS00329
Number of Residues14
DetailsHSP70_2 Heat shock hsp70 proteins family signature 2. IFDLGGGTfdvSIL
ChainResidueDetails
AILE197-LEU210

site_idPS01036
Number of Residues15
DetailsHSP70_3 Heat shock hsp70 proteins family signature 3. IvLvGGsTRIPkIqK
ChainResidueDetails
AILE334-LYS348

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:20068231
ChainResidueDetails
BSER152
ALYS71

site_idSWS_FT_FI2
Number of Residues7
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:P19120
ChainResidueDetails
ATHR14
ATYR15
AGLY202
AGLU268
ALYS271
ASER275
AGLY339

site_idSWS_FT_FI3
Number of Residues1
DetailsMOD_RES: N-acetylserine => ECO:0000269|Ref.5, ECO:0000269|Ref.6, ECO:0007744|PubMed:19413330
ChainResidueDetails
ASER2

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: N6-acetyllysine => ECO:0000250|UniProtKB:P63017
ChainResidueDetails
ALYS108
ALYS328

site_idSWS_FT_FI5
Number of Residues1
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:17525332
ChainResidueDetails
ASER153

site_idSWS_FT_FI6
Number of Residues1
DetailsMOD_RES: N6-acetyllysine => ECO:0007744|PubMed:19608861
ChainResidueDetails
ALYS246

site_idSWS_FT_FI7
Number of Residues1
DetailsMOD_RES: N6-succinyllysine; alternate => ECO:0000250|UniProtKB:P63017
ChainResidueDetails
ALYS319

site_idSWS_FT_FI8
Number of Residues1
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:23186163
ChainResidueDetails
ASER329

site_idSWS_FT_FI9
Number of Residues1
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:20068231
ChainResidueDetails
ASER362

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PDB entries from 2024-08-07

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