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Unc-51-like kinase 3 (ULK3) in complex with momelotinib

Analyse Unc-51-like kinase 3 (ULK3) in complex with momelotinib in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6FDZ
Type
protein
Length
265 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SERINE/THREONINE-protein kinase ULK3
EC
2.7.11.1
UniProt
Q6PHR2
Ligands
C87
Pockets
2 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
USERINE/THREONINE-protein kinase ULK3 (EC 2.7.11.1)protein26534% helix, 18% strandQ6PHR2

Ligands and binding sites

  • C87 · Momelotinib · ligand · chains U

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

Pockets

2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15660.750.8263C87
2690.340.7514empty

Compared structures

  • 6FDZ · Unc-51-Like Kinase 3 (ULK3) In Complex With Momelotinib · the same entry in another collection · chain U against U, TM-score 1.00
  • Q6PHR2 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein kinase ULK3 (Q6PHR2) · a predicted model of the same protein · chain U against A, TM-score 0.90

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