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MolNFT v1 · #78577 · protein

1.7 ångström resolution crystal structure of putative phosphatase from clostridium difficile

3SD7: “1.7 ångström resolution crystal structure of putative phosphatase from clostridium difficile”. X-ray diffraction, 2 ligands (NA, CL), 1 pocket (best druggability 0.73). MolNFT v1 #78577 on GenesisL1: 3D structure, binding sites and…

PDB
3SD7
Type
protein
Length
215 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative phosphatase
UniProt
Q181K6
Ligands
NA, CL
Pockets
1 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative phosphataseprotein21551% helix, 17% strandQ181K6

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • CL · Chloride ion · ion · chains A
  • GOL · Glycerol · additive · 2 copies · chains A
  • PGE · Triethylene glycol · additive · chains A

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
15250.730.8141NA, CL

Compared structures

  • 3SD7 · 1.7 Angstrom Resolution Crystal Structure of Putative Phosphatase from Clostridium… · the same entry in another collection · chain A against A, TM-score 1.00

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