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4NH7

Correlation between chemotype-dependent binding conformations of HSP90 alpha/beta and isoform selectivity

Functional Information from GO Data
ChainGOidnamespacecontents
A0005524molecular_functionATP binding
A0006457biological_processprotein folding
A0016887molecular_functionATP hydrolysis activity
A0051082molecular_functionunfolded protein binding
A0140662molecular_functionATP-dependent protein folding chaperone
B0005524molecular_functionATP binding
B0006457biological_processprotein folding
B0016887molecular_functionATP hydrolysis activity
B0051082molecular_functionunfolded protein binding
B0140662molecular_functionATP-dependent protein folding chaperone
Functional Information from PDB Data
site_idAC1
Number of Residues13
DetailsBINDING SITE FOR RESIDUE HIE A 301
ChainResidue
AALA55
AGOL302
AGOL304
AHOH401
AHOH450
ALYS58
AASP93
ALEU107
AALA111
AGLY135
ATYR139
ATRP162
ATHR184

site_idAC2
Number of Residues10
DetailsBINDING SITE FOR RESIDUE GOL A 302
ChainResidue
ALEU107
AILE110
AE0G301
AGOL304
AHOH407
AHOH484
AHOH511
BLYS58
BTYR61
BHOH410

site_idAC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 303
ChainResidue
ALYS58
AHOH402
AHOH418
AHOH445
BE0G301
BGOL303
BHOH529

site_idAC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL A 304
ChainResidue
AASN51
AASP54
AE0G301
AGOL302
AHOH478
AHOH526

site_idAC5
Number of Residues16
DetailsBINDING SITE FOR RESIDUE HIE B 301
ChainResidue
AGOL303
BALA55
BLYS58
BASP93
BLEU107
BALA111
BGLY135
BPHE138
BTYR139
BTRP162
BTHR184
BGOL302
BGOL303
BHOH402
BHOH404
BHOH447

site_idAC6
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL B 302
ChainResidue
BGLN23
BLEU103
BILE104
BTYR139
BTRP162
BPHE170
BE0G301
BHOH406

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL B 303
ChainResidue
AGOL303
BASN51
BASP54
BGLY135
BE0G301
BHOH529

Functional Information from PROSITE/UniProt
site_idPS00298
Number of Residues10
DetailsHSP90 Heat shock hsp90 proteins family signature. YsNKEIFLRE
ChainResidueDetails
ATYR38-GLU47

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsBINDING:
ChainResidueDetails
AGLU16
BGLU16

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0000269|PubMed:2492519, ECO:0007744|PubMed:17081983, ECO:0007744|PubMed:18318008, ECO:0007744|PubMed:23186163, ECO:0007744|PubMed:24275569
ChainResidueDetails
ATHR109
BTHR109

site_idSWS_FT_FI3
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0007744|PubMed:18088087, ECO:0007744|PubMed:21406692, ECO:0007744|PubMed:23186163
ChainResidueDetails
AMET130
BMET130

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphoserine => ECO:0000269|PubMed:2492519, ECO:0007744|PubMed:16807684, ECO:0007744|PubMed:17081983, ECO:0007744|PubMed:18088087, ECO:0007744|PubMed:18318008, ECO:0007744|PubMed:18669648, ECO:0007744|PubMed:18691976, ECO:0007744|PubMed:19367720, ECO:0007744|PubMed:23186163
ChainResidueDetails
AALA141
BALA141

site_idSWS_FT_FI5
Number of Residues2
DetailsMOD_RES: Phosphotyrosine => ECO:0000250|UniProtKB:P07901
ChainResidueDetails
ALYS191
BLYS191

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PDB entries from 2024-07-24

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