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MolNFT v1 · #136659 · protein

Structure of hutd from pseudomonas fluorescens SBW25 (formate condition)

5V00 · Uncharacterized protein: “Structure of hutd from pseudomonas fluorescens SBW25 (formate condition)”. X-ray diffraction, 3 pockets (best druggability 0.74). MolNFT v1 #136659 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5V00
Type
protein
Length
369 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
C3K802
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 2% helix, 57% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized proteinprotein1842% helix, 57% strandC3K802
BUncharacterized proteinprotein1852% helix, 56% strandC3K802

Ligands and binding sites

  • FMT · Formic acid · additive · 10 copies · chains A, B
  • GOL · Glycerol · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1800.740.9718empty
21560.550.8121FMT, GOL
31250.550.8219GOL, FMT

Interfaces

1 interface between chains.

  • A–B · 1027 Ų buried · 24 hydrogen bonds · protein-protein

Compared structures

  • 5V00 · Structure of HutD from Pseudomonas fluorescens SBW25 (Formate condition) · the same entry in another collection · chain B against B, TM-score 1.00

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