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MolNFT v1 · #174596 · protein + DNA

Crystal structure of chimeric mutant of GH5 in complex with Z-DNA

7C0J · Histone H5,DOUBLE-stranded RNA-specific adenosine deaminase: “Crystal structure of chimeric mutant of GH5 in complex with Z-DNA”. X-ray diffraction, 1 pocket (best druggability 0.46). MolNFT v1 #174596 on GenesisL1: 3D structure…

PDB
7C0J
Type
protein + DNA
Length
133 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H5,DOUBLE-stranded RNA-specific adenosine deaminase; DNA…
UniProt
P02259, P55265
Pockets
1 · best druggability 0.46

Structure

x-ray diffraction · 3 distinct chains · 58% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone H5,DOUBLE-stranded RNA-specific adenosine deaminaseprotein5959% helix, 15% strandP02259, P55265
BHistone H5,DOUBLE-stranded RNA-specific adenosine deaminaseprotein6256% helix, 15% strandP02259, P55265
D, EDNA (5'-D(*TP*CP*GP*CP*GP*CP*G)-3')dna6——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1840.460.8217empty

Interfaces

6 interfaces between chains.

  • A–D · 380 Ų buried · 5 hydrogen bonds · protein-nucleic
  • B–E · 368 Ų buried · 4 hydrogen bonds · protein-nucleic
  • D–E · 328 Ų buried · 32 hydrogen bonds · nucleic-nucleic
  • A–E · 25 Ų buried · 0 hydrogen bonds · protein-nucleic
  • A–B · 14 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7C0J · Crystal structure of chimeric mutant of GH5 in complex with Z-DNA · the same entry in another collection · chain E against E, TM-score 1.00
  • P02259 · AlphaFold monomer V2.0 prediction for histone H5 (P02259) · a predicted model of the same protein · chain B against A, TM-score 0.88
  • P55265 · AlphaFold monomer V2.0 prediction for double-stranded RNA-specific adenosine deaminase… · a predicted model of the same protein · chain A against A, TM-score 0.79

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