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PDBsum entry 3cy2
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Contents |
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* Residue conservation analysis
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PDB id:
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Transferase
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Title:
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Crystal structure of human proto-oncogene serine threonine kinase (pim1) in complex with a consensus peptide and a beta carboline ligand ii
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Structure:
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Proto-oncogene serine/threonine-protein kinase pim-1, isoform 2. Chain: a. Engineered: yes. Pimtide peptide. Chain: b. Engineered: yes
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Source:
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Homo sapiens. Organism_taxid: 9606. Gene: pim1. Expressed in: escherichia coli. Expression_system_taxid: 562. Synthetic: yes. Other_details: synthetic peptide
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Resolution:
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2.01Å
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R-factor:
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0.169
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R-free:
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0.199
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Authors:
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P.Filippakopoulos,A.Bullock,O.Fedorov,K.Huber,F.Bracher,A.C.W.Pike, F.Von Delft,C.H.Arrowsmith,A.M.Edwards,C.Bountra,S.Knapp,Structural Genomics Consortium (Sgc)
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Key ref:
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K.Huber
et al.
(2012).
7,8-dichloro-1-oxo-β-carbolines as a versatile scaffold for the development of potent and selective kinase inhibitors with unusual binding modes.
J Med Chem,
55,
403-413.
PubMed id:
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Date:
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25-Apr-08
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Release date:
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15-Jul-08
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PROCHECK
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Headers
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References
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P11309
(PIM1_HUMAN) -
Serine/threonine-protein kinase pim-1 from Homo sapiens
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Seq:
Struc:
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313 a.a.
271 a.a.*
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Key: |
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PfamA domain |
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Secondary structure |
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CATH domain |
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*
PDB and UniProt seqs differ
at 1 residue position (black
cross)
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Enzyme class:
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E.C.2.7.11.1
- non-specific serine/threonine protein kinase.
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Reaction:
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1.
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L-seryl-[protein] + ATP = O-phospho-L-seryl-[protein] + ADP + H+
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2.
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L-threonyl-[protein] + ATP = O-phospho-L-threonyl-[protein] + ADP + H+
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L-seryl-[protein]
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+
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ATP
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=
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O-phospho-L-seryl-[protein]
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+
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ADP
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+
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H(+)
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L-threonyl-[protein]
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+
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ATP
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=
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O-phospho-L-threonyl-[protein]
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+
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ADP
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+
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H(+)
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Molecule diagrams generated from .mol files obtained from the
KEGG ftp site
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J Med Chem
55:403-413
(2012)
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PubMed id:
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7,8-dichloro-1-oxo-β-carbolines as a versatile scaffold for the development of potent and selective kinase inhibitors with unusual binding modes.
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K.Huber,
L.Brault,
O.Fedorov,
C.Gasser,
P.Filippakopoulos,
A.N.Bullock,
D.Fabbro,
J.Trappe,
J.Schwaller,
S.Knapp,
F.Bracher.
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ABSTRACT
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Links
