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MolNFT v1 · #91443 · protein

Crystal structure of an archaeal mcm filament

4FDG · Minichromosome maintenance protein mcm: “Crystal structure of an archaeal mcm filament”. X-ray diffraction, 1 ligand (ZN), 20 pockets (best druggability 0.82). MolNFT v1 #91443 on GenesisL1: 3D structure, binding sites and pockets…

PDB
4FDG
Type
protein
Length
2,960 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Minichromosome maintenance protein mcm
EC
3.6.4.12
UniProt
Q9UXG1
Ligands
ZN
Pockets
20 · best druggability 0.82

Structure

x-ray diffraction · 1 distinct chain · 28% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B, A, C, D, EMinichromosome maintenance protein mcm (EC 3.6.4.12)protein59228% helix, 19% strandQ9UXG1

Ligands and binding sites

  • ZN · Zinc ion · metal · 5 copies · chains B, A, C, D, E

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110450.820.8389empty
210600.820.8395empty
311800.820.83104empty
411240.820.83101empty
56210.780.8463empty

Interfaces

4 interfaces between chains.

  • A–D · 1855 Ų buried · 12 hydrogen bonds · protein-protein
  • B–A · 1827 Ų buried · 12 hydrogen bonds · protein-protein
  • B–C · 1817 Ų buried · 20 hydrogen bonds · protein-protein
  • C–E · 1783 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 4FDG · Crystal Structure of an Archaeal MCM Filament · the same entry in another collection · chain B against B, TM-score 1.00
  • Q9UXG1 · AlphaFold monomer V2.0 prediction for minichromosome maintenance protein mcm (Q9UXG1) · a predicted model of the same protein · chain B against A, TM-score 0.89

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