PDBsum entry 3o51

Transferase

PDB id: 3o51

Contents

Protein chain

246 a.a. *

Ligands

LJF

* Residue conservation analysis

PDB id:

3o51

Name:

Transferase

Title:

Crystal structure of anthranilamide 10 bound to auroraa

Structure:

Cdna flj58295, highly similar to serine/threonine-protein kinase 6. Chain: a. Fragment: auroraa kinase domain (unp residues 57 to 323). Engineered: yes

Source:

Homo sapiens. Human. Organism_taxid: 9606. Expressed in: spodoptera frugiperda. Expression_system_taxid: 7108

Resolution:

3.20Å R-factor: 0.288 R-free: 0.304

Authors:

X.Huang

Key ref:

V.J.Cee et al. (2010). Discovery of a potent, selective, and orally bioavailable pyridinyl-pyrimidine phthalazine aurora kinase inhibitor. J Med Chem, 53, 6368-6377. PubMed id: 20684549

Date:

27-Jul-10 Release date: 18-Aug-10

Protein chain

O14965  (AURKA_HUMAN) -  Aurora kinase A from Homo sapiens

Seq: 403 a.a.

Struc: 246 a.a.

Enzyme reactions

• Enzyme class: E.C.2.7.11.1 - non-specific serine/threonine protein kinase.
• Reaction:
  1. L-seryl-[protein] + ATP = O-phospho-L-seryl-[protein] + ADP + H⁺
  2. L-threonyl-[protein] + ATP = O-phospho-L-threonyl-[protein] + ADP + H⁺

Molecule diagrams generated from .mol files obtained from the KEGG ftp site

reference

J Med Chem 53:6368-6377 (2010)

PubMed id: 20684549

Discovery of a potent, selective, and orally bioavailable pyridinyl-pyrimidine phthalazine aurora kinase inhibitor.

V.J.Cee, L.B.Schenkel, B.L.Hodous, H.L.Deak, H.N.Nguyen, P.R.Olivieri, K.Romero, A.Bak, X.Be, S.Bellon, T.L.Bush, A.C.Cheng, G.Chung, S.Coats, P.M.Eden, K.Hanestad, P.L.Gallant, Y.Gu, X.Huang, R.L.Kendall, M.H.Lin, M.J.Morrison, V.F.Patel, R.Radinsky, P.E.Rose, S.Ross, J.R.Sun, J.Tang, H.Zhao, M.Payton, S.D.Geuns-Meyer.

ABSTRACT

No abstract given.