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MolNFT v1 · #56878 · protein

Mtruva form II

2ZTC · Holliday junction ATP-dependent DNA helicase ruva: “Mtruva form II”. X-ray diffraction, 6 pockets (best druggability 0.84). MolNFT v1 #56878 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2ZTC
Type
protein
Length
750 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Holliday junction ATP-dependent DNA helicase ruva
EC
3.6.1.-
UniProt
P66744
Pockets
6 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 49% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DHolliday junction ATP-dependent DNA helicase ruva (EC 3.6.1.-)protein18849% helix, 22% strandP66744
B, CHolliday junction ATP-dependent DNA helicase ruva (EC 3.6.1.-)protein18748% helix, 22% strandP66744

Ligands and binding sites

  • GOL · Glycerol · additive · 4 copies · chains A, B, C, D

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

Pockets

6 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12230.840.9535empty
24810.670.7852empty
35160.670.7854empty
44880.660.7856empty
54310.640.7851GOL

Interfaces

6 interfaces between chains.

  • A–C · 1291 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 1289 Ų buried · 9 hydrogen bonds · protein-protein
  • B–D · 1279 Ų buried · 7 hydrogen bonds · protein-protein
  • C–D · 1269 Ų buried · 11 hydrogen bonds · protein-protein
  • B–C · 22 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2ZTC · MtRuvA Form II · the same entry in another collection · chain A against A, TM-score 1.00

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