PDB entry 5m4p
View 5m4p on RCSB PDB site
Description: Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase
Class: transferase
Keywords: Off-Rate Screening, PDHK, HSP90, SPR, kinase inhibitors, fragment screening, cancer, PDK1, PDK2, PDK3, PDK4, Transferase
Deposited on
2016-10-18, released
2017-02-22
The last revision prior to the SCOPe 2.08 freeze date was dated
2018-10-24, with a file datestamp of
2018-10-19.
Experiment type: XRAY
Resolution: 2.3 Å
R-factor: N/A
AEROSPACI score: 0.24
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: [pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial
Species: Homo sapiens [TaxId:9606]
Gene: PDK2, PDHK2
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.08: d5m4pa1, d5m4pa2 - Heterogens: 7FE, TF3, CL, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>5m4pA (A:)
mrwvwallknaslagsapkyiehfskfspsplsmkqfldfgssnacektsftflrqelpv
rlanimkeinllpdrvlstpsvqlvqswyvqslldimefldkdpedhrtlsqftdalvti
rnrhndvvptmaqgvleykdtygddpvsnqniqyfldrfylsrisirmlinqhtlifdgs
tnpahpkhigsidpncnvsevvkdaydmakllcdkyymaspdleiqeinaanskqpihmv
yvpshlyhmlfelfknamratveshesslilppikvmvalgeedlsikmsdrgggvplrk
ierlfsymystaptpqpgtggtplagfgyglpisrlyakyfqgdlqlfsmegfgtdaviy
lkalstdsverlpvynksawrhyqtiqeagdwcvpstepkntstyrvs
Sequence, based on observed residues (ATOM records): (download)
>5m4pA (A:)
gsapkyiehfskfspsplsmkqfldfgsnacektsftflrqelpvrlanimkeinllpdr
vlstpsvqlvqswyvqslldimefldkdpedhrtlsqftdalvtirnrhndvvptmaqgv
leykdtygddpvsnqniqyfldrfylsrisirmlinqhtlifdpkhigsidpncnvsevv
kdaydmakllcdkyymaspdleiqeinaanskqpihmvyvpshlyhmlfelfknamratv
eshesslilppikvmvalgeedlsikmsdrgggvplrkierlfsymystaplagfgyglp
isrlyakyfqgdlqlfsmegfgtdaviylkalstdsverlpvy