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MolNFT v1 · #69903 · protein

Structural basis of membrane-targeting by DOCK180

3L4C · Dedicator of cytokinesis protein 1: “Structural basis of membrane-targeting by DOCK180”. X-ray diffraction, 3 pockets (best druggability 0.39). MolNFT v1 #69903 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3L4C
Type
protein
Length
357 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dedicator of cytokinesis protein 1
UniProt
Q14185
Pockets
3 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 8% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADedicator of cytokinesis protein 1protein1787% helix, 44% strandQ14185
BDedicator of cytokinesis protein 1protein1799% helix, 43% strandQ14185

Ligands and binding sites

  • BME · Beta-mercaptoethanol · additive · 2 copies · chains A, B

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1940.390.7717empty
2640.380.7921empty
3750.320.7519empty

Interfaces

1 interface between chains.

  • A–B · 207 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (additive adduct).

Compared structures

  • 3L4C · Structural basis of membrane-targeting by Dock180 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q14185 · AlphaFold monomer V2.0 prediction for dedicator of cytokinesis protein 1 (Q14185) · a predicted model of the same protein · chain A against A, TM-score 0.94

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