Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

6ELN

Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation

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
Functional Information from PDB Data
site_idAC1
Number of Residues15
Detailsbinding site for residue P4A A 301
ChainResidue
ALEU48
AGLY108
ATHR184
AVAL186
ASO4302
AHOH453
AHOH493
AASN51
AALA55
ALYS58
AASP93
AILE96
AGLY97
AMET98
ALEU107

site_idAC2
Number of Residues11
Detailsbinding site for residue SO4 A 302
ChainResidue
AASP57
ALYS58
AGLY108
AP4A301
AHOH419
AHOH430
AHOH450
AHOH456
AHOH472
AHOH520
AHOH577

site_idAC3
Number of Residues2
Detailsbinding site for residue SO4 A 303
ChainResidue
AHIS210
AHOH495

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 Residues3
DetailsBinding site: {}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues1
DetailsBinding site: {"evidences":[{"evidenceCode":"ECO:0000250"}]}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues2
DetailsModified residue: {"description":"N6-acetyllysine","evidences":[{"source":"UniProtKB","id":"P07901","evidenceCode":"ECO:0000250"}]}
ChainResidueDetails

246704

PDB entries from 2025-12-24

PDB statisticsPDBj update infoContact PDBjnumon