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MolNFT v1 · #25109 · protein

Crystal structure of the KIF1A motor domain complexed with mg-amppnp

1VFV · Protein (fusion protein consisting of kinesin-like protein…: “Crystal structure of the KIF1A motor domain complexed with mg-amppnp”. X-ray diffraction, 2 ligands (ANP, MG), 3 pockets (best druggability 0.56). MolNFT v1 #25109 on…

PDB
1VFV
Type
protein
Length
324 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (fusion protein consisting of kinesin-like protein KIF1A, kinesin heavy chain…
UniProt
P33173, P28738
Ligands
ANP, MG
Pockets
3 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein (fusion protein consisting of kinesin-like protein KIF1A, kinesin heavy chain isoform 5C and a his tagprotein32430% helix, 31% strandP33173, P28738

Ligands and binding sites

  • ANP · Phosphoaminophosphonic acid-adenylate ester · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12660.560.7731empty
21570.410.7428MG, ANP
3510.290.7611empty

Compared structures

  • 1VFV · Crystal Structure of the Kif1A Motor Domain Complexed With Mg-AMPPNP · the same entry in another collection · chain A against A, TM-score 1.00
  • P33173 · AlphaFold monomer V2.0 prediction for kinesin-like protein KIF1A (P33173) · a predicted model of the same protein · chain A against A, TM-score 0.98
  • P28738 · AlphaFold monomer V2.0 prediction for kinesin heavy chain isoform 5C (P28738) · a predicted model of the same protein · chain A against A, TM-score 0.90

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