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MolNFT v1 · #147740 · protein

Crystal structure of RRP1 from chaetomium thermophilum in space group C2

6EMF · G0S4M2: “Crystal structure of RRP1 from chaetomium thermophilum in space group C2”. X-ray diffraction, 1 ligand (PRO), 1 pocket (best druggability 0.75). MolNFT v1 #147740 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6EMF
Type
protein
Length
461 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
G0S4M2
UniProt
G0S4M2
Ligands
PRO
Pockets
1 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 70% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AG0S4M2protein22870% helix, 4% strandG0S4M2
BG0S4M2protein23370% helix, 3% strandG0S4M2

Ligands and binding sites

  • PRO · Proline · ligand · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 7 copies · chains A, 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111820.750.7883PRO

Interfaces

1 interface between chains.

  • A–B · 637 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6EMF · Crystal structure of Rrp1 from Chaetomium thermophilum in space group C2 · the same entry in another collection · chain A against A, TM-score 1.00

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