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MolNFT v1 · #49956 · protein

Crystal structure of the protein of unknown function from enterococcus faecalis

2R41 · Uncharacterized protein: “Crystal structure of the protein of unknown function from enterococcus faecalis”. X-ray diffraction, 3 pockets (best druggability 0.67). MolNFT v1 #49956 on GenesisL1: 3D structure, binding sites and…

PDB
2R41
Type
protein
Length
417 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
Q837L7
Pockets
3 · best druggability 0.67

Structure

x-ray diffraction · 4 distinct chains · 21% helix, 39% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized proteinprotein10321% helix, 40% strandQ837L7
BUncharacterized proteinprotein10421% helix, 39% strandQ837L7
CUncharacterized proteinprotein10621% helix, 38% strandQ837L7
DUncharacterized proteinprotein10421% helix, 38% strandQ837L7

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15210.670.7882empty
23820.560.7455empty
3530.280.7517empty

Interfaces

5 interfaces between chains.

  • A–B · 664 Ų buried · 10 hydrogen bonds · protein-protein
  • B–D · 607 Ų buried · 2 hydrogen bonds · protein-protein
  • A–C · 601 Ų buried · 0 hydrogen bonds · protein-protein
  • B–C · 255 Ų buried · 1 hydrogen bond · protein-protein
  • A–D · 252 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 modified (engineered).

Compared structures

  • 2R41 · Crystal structure of the protein of unknown function from Enterococcus faecalis · the same entry in another collection · chain A against A, TM-score 1.00

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