MolNFT v1 · #162283 · protein

Aurora-a in complex with shape-diverse fragment 56

6R4B: “Aurora-a in complex with shape-diverse fragment 56”. X-ray diffraction, 4 ligands (ADP, JSN, MG). MolNFT v1 #162283 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6R4B
Type: protein
Length: 265 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt: O14965
Ligands: ADP, JSN, MG, CL

Structure

x-ray diffraction · 1 distinct chain.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	—	protein	265	—	O14965

Ligands and binding sites

ADP · Adenosine-5'-diphosphate · ligand · chains A
JSN · (6~{S})-6-[2,4-bis(fluoranyl)phenyl]-~{N},~{N},4-trimethyl-2-oxidanylidene-5,6-dihydro-1~{H}-pyrimidine-5-carboxamide · ligand · chains A
MG · Magnesium ion · metal · 2 copies · chains A
CL · Chloride ion · ion · 4 copies · chains A

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

Compared structures

6R4B · Aurora-A in complex with shape-diverse fragment 56 · the same entry in another collection · chain A against A, TM-score 1.00
O14965 · AlphaFold monomer V2.0 prediction for aurora kinase a (O14965) · a predicted model of the same protein · chain A against A, TM-score 0.97

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt O14965
Elsewhere: RCSB PDB 6R4B · PDBe 6R4B · UniProt O14965

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