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MolNFT v1 · #56350 · protein

Ubiquitin crystallized under high pressure

2ZCC: “Ubiquitin crystallized under high pressure”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability 0.49). MolNFT v1 #56350 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2ZCC
Type
protein
Length
211 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin
UniProt
P62974
Ligands
ZN
Pockets
1 · best druggability 0.49

Structure

x-ray diffraction · 2 distinct chains · 26% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BUbiquitinprotein7026% helix, 30% strandP62974
CUbiquitinprotein7125% helix, 30% strandP62974

Ligands and binding sites

  • ZN · Zinc ion · metal · 6 copies · chains A, C, 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
12490.490.7426empty

Interfaces

3 interfaces between chains.

  • B–C · 341 Ų buried · 2 hydrogen bonds · protein-protein
  • A–C · 327 Ų buried · 4 hydrogen bonds · protein-protein
  • A–B · 47 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2ZCC · Ubiquitin crystallized under high pressure · the same entry in another collection · chain A against A, TM-score 1.00

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