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MolNFT v1 · #61572 · protein

Cfms tyrosine kinase in complex with a pyridopyrimidinone inhibitor

3DPK · Macrophage colony-stimulating factor 1 receptor, fibroblast…: “Cfms tyrosine kinase in complex with a pyridopyrimidinone inhibitor”. X-ray diffraction, 2 ligands (8C5, SO4), 2 pockets (best druggability 0.67). MolNFT v1 #61572 on…

PDB
3DPK
Type
protein
Length
279 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Macrophage colony-stimulating factor 1 receptor, fibroblast growth factor receptor 1
EC
2.7.10.1
UniProt
P07333, P11362
Ligands
8C5, SO4
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMacrophage colony-stimulating factor 1 receptor, fibroblast growth factor receptor 1 (EC 2.7.10.1)protein27941% helix, 20% strandP07333, P11362

Ligands and binding sites

  • 8C5 · 8-cyclohexyl-N-methoxy-5-oxo-2-{[4-(2-pyrrolidin-1-ylethyl)phenyl]amino}-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxamide · ligand · chains A
  • SO4 · Sulfate ion · ion · 3 copies · chains A

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
12510.670.84398C5
21730.490.7730SO4

Compared structures

  • 3DPK · cFMS tyrosine kinase in complex with a pyridopyrimidi inhibitor · the same entry in another collection · chain A against A, TM-score 1.00
  • P07333 · AlphaFold monomer V2.0 prediction for macrophage colony-stimulating factor 1 receptor… · a predicted model of the same protein · chain A against A, TM-score 0.93
  • P11362 · AlphaFold monomer V2.0 prediction for fibroblast growth factor receptor 1 (P11362) · a predicted model of the same protein · chain A against A, TM-score 0.87

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