Brand  (β version)

PDB ID: 5VCW

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Ligands
Code Name Style Show Link
93J (2e)-N-{4-[(3-chloro-4-fluorophenyl)amino]-3-cyano-7-ethoxyquinolin-6-yl}-4-(dimethylamino)but-2-enamide PoSSuM
SO4 Sulfate ion PoSSuM
EDO 1,2-ethanediol PoSSuM
Non-standard Residues
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Structure summary

Code : 5VCW   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE/TRANSFERASE INHIBITOR
Title : CRYSTAL STRUCTURE OF HUMAN MYT1 KINASE DOMAIN IN COMPLEX WITH Pelitinib
Release Data : 2017-08-23
Compound :
mol_id molecule chains synonym
1 Membrane-associated tyrosine- and threonine-specific cdc2-inhibitory kinase A,B Myt1 kinase
ec: 2.7.11.1
fragment: KINASE DOMAIN, UNP RESIDUES 75-362
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human ESCHERICHIA COLI  (taxid:469008)
gene: PKMYT1, MYT1
expression_system_strain: BL21(DE3)-RIPL
expression_system_vector_type: PLASMID
expression_system_plasmid: PNIC28-BSA4
Authors : Zhu, J.-Y., Schonbrunn, E.
Keywords : KINASE DOMAIN, CELL CYCLE, TYROSINE- AND THREONINE-SPECIFIC KINASE, MEMBRANE-ASSOCIATED PROTEIN KINASE, TRANSFERASE, INHIBITOR, TRANSFERASE-TRANSFERASE INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 2.2500 Å )
Citation :

Structural Basis of Wee Kinases Functionality and Inactivation by Diverse Small Molecule Inhibitors.

Zhu, J.Y.,Cuellar, R.A.,Berndt, N.  et al.
(2017)  J. Med. Chem.  60 : 7863 - 7875

PubMed: 28792760
DOI: 10.1021/acs.jmedchem.7b00996

Reaction

Chain : A, B
UniProt : Q99640 (PMYT1_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
L-seryl-[protein] + ATP = O-phospho-L-seryl-[protein] + ADP + H(+) 2.7.11.1 ECO:0000305
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L-threonyl-[protein] + ATP = O-phospho-L-threonyl-[protein] + ADP + H(+) 2.7.11.1 PubMed:10373560, PubMed:10504341, PubMed:9001210
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