2JJC

Hsp90 alpha ATPase domain with bound small molecule fragment

Summary for 2JJC

Related2CDD 1UY9 1BYQ 2BSM 1OSF 1UY8 2BUG 2UWD 2BT0 1UYG 2CCU 2BZ5 2CCS 1YC3 1UYF 1UYI 1UYD 2BYI 1UY6 2VCI 2VCJ 1YC4 2C2L 1UYH 1UYK 2CCT 1UYL 1UYE 1YC1 1UY7 1UYC 2BYH
DescriptorHEAT SHOCK PROTEIN HSP 90-ALPHA, DIMETHYL SULFOXIDE, PYRIMIDIN-2-AMINE, ... (4 entities in total)
Functional Keywordshsp90, atpase, chaperone, cytoplasm, heat shock, nucleotide-binding, alternative splicing, atp-binding, phosphoprotein, stress response
Biological sourceHOMO SAPIENS (HUMAN)
Cellular locationCytoplasm  P07900
Total number of polymer chains1
Total molecular weight24579.8
Authors
Congreve, M.,Chessari, G.,Tisi, D.,Woodhead, A.J. (deposition date: 2008-03-31, release date: 2008-07-15, Last modification date: 2017-07-05)
Primary citation
Congreve, M.,Chessari, G.,Tisi, D.,Woodhead, A.J.
Recent Developments in Fragment-Based Drug Discovery.
J.Med.Chem., 51:3661-, 2008
PubMed: 18457385 (PDB entries with the same primary citation)
DOI: 10.1021/JM8000373
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.95 Å)
NMR Information
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.221101.1%3.9%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution