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MolNFT v1 · #115104 · protein

Crystal structure of GEMC1 coiled-coil domain

5C9N · Geminin coiled-coil domain-containing protein 1: “Crystal structure of GEMC1 coiled-coil domain”. X-ray diffraction, 1 pocket (best druggability 0.30). MolNFT v1 #115104 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5C9N
Type
protein
Length
125 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Geminin coiled-coil domain-containing protein 1
UniProt
A6NCL1
Pockets
1 · best druggability 0.30

Structure

x-ray diffraction · 2 distinct chains · 94% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGeminin coiled-coil domain-containing protein 1protein6495% helix, 0% strandA6NCL1
BGeminin coiled-coil domain-containing protein 1protein6192% helix, 0% strandA6NCL1

Ligands and binding sites

  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1500.300.7612empty

Interfaces

1 interface between chains.

  • A–B · 1499 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 5C9N · Crystal structure of GEMC1 coiled-coil domain · the same entry in another collection · chain A against A, TM-score 1.00
  • A6NCL1 · AlphaFold monomer V2.0 prediction for geminin coiled-coil domain- containing protein 1… · a predicted model of the same protein · chain A against A, TM-score 0.89

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