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MolNFT v1 · #58540 · protein

Crystal structure of the motor domain of human kinesin family member 3C in complex with ADP

3B6V · Kinesin-like protein KIF3C: “Crystal structure of the motor domain of human kinesin family member 3C in complex with ADP”. X-ray diffraction, 3 ligands (ADP, MG, UNX), 5 pockets (best druggability 0.72). MolNFT v1 #58540 on…

PDB
3B6V
Type
protein
Length
608 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Kinesin-like protein KIF3C
UniProt
O14782
Ligands
ADP, MG, UNX
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 31% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AKinesin-like protein KIF3Cprotein30632% helix, 30% strandO14782
BKinesin-like protein KIF3Cprotein30231% helix, 30% strandO14782

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B
  • UNX · Unknown atom or ion · ion · 8 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16900.720.7999MG, ADP
24820.670.7839empty
31660.560.8130UNX
4880.360.7515empty
5690.320.7413empty

Interfaces

1 interface between chains.

  • A–B · 1002 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 3B6V · Crystal structure of the motor domain of human kinesin family member 3C in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • O14782 · AlphaFold monomer V2.0 prediction for kinesin-like protein KIF3C (O14782) · a predicted model of the same protein · chain B against A, TM-score 0.98

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