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MolNFT v1 · #145482 · protein

Structure of dephosphorylated aurora a (122-403) in complex with inhibiting monobody and AT9283 in an inactive conformation

6CPG: “Structure of dephosphorylated aurora a (122-403) in complex with inhibiting monobody and AT9283 in an…”. X-ray diffraction, 1 ligand (35R). MolNFT v1 #145482 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6CPG
Type
protein
Length
678 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
O14965
Ligands
35R

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein249—O14965
B—protein89——
D—protein252—O14965
E—protein88——

Ligands and binding sites

  • 35R · 1-cyclopropyl-3-{3-[5-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl}urea · ligand · 2 copies · chains A, D

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • O14965 · AlphaFold monomer V2.0 prediction for aurora kinase a (O14965) · a predicted model of the same protein · chain D against A, TM-score 0.95

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