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MolNFT v1 · #126818 · protein

Crystal structure of yeast CDT1 C-terminal domain

5MEB · Cell division cycle protein CDT1: “Crystal structure of yeast CDT1 C-terminal domain”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.40). MolNFT v1 #126818 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5MEB
Type
protein
Length
221 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cell division cycle protein CDT1
UniProt
P47112
Ligands
SO4
Pockets
2 · best druggability 0.40

Structure

x-ray diffraction · 2 distinct chains · 62% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACell division cycle protein CDT1protein11263% helix, 9% strandP47112
BCell division cycle protein CDT1protein10961% helix, 13% strandP47112

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1750.400.7915empty
2610.310.7513empty

Interfaces

1 interface between chains.

  • A–B · 324 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 5MEB · Crystal structure of yeast Cdt1 C-terminal domain · the same entry in another collection · chain A against A, TM-score 1.00
  • P47112 · AlphaFold monomer V2.0 prediction for cell division cycle protein CDT1 (P47112) · a predicted model of the same protein · chain B against A, TM-score 0.84

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