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MolNFT v1 · #98432 · protein

Crystal structure of the PKD1 domain from vibrio cholerae metalloprotease prtv

4L9D: “Crystal structure of the PKD1 domain from vibrio cholerae metalloprotease prtv”. X-ray diffraction, 3 ligands (NA, CA, CL). MolNFT v1 #98432 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4L9D
Type
protein
Length
163 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protease
UniProt
C3LUP3
Ligands
NA, CA, CL

Structure

x-ray diffraction · 2 distinct chains · 0% helix, 58% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProteaseprotein820% helix, 57% strandC3LUP3
BProteaseprotein810% helix, 58% strandC3LUP3

Ligands and binding sites

  • NA · Sodium ion · metal · 3 copies · chains A, B
  • CA · Calcium ion · metal · chains B
  • CL · Chloride ion · ion · 3 copies · chains A, B
  • PEG · Di(hydroxyethyl)ether · additive · chains B

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

Interfaces

1 interface between chains.

  • A–B · 749 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 4L9D · Crystal structure of the PKD1 domain from Vibrio cholerae metalloprotease PrtV · the same entry in another collection · chain A against A, TM-score 1.00
  • C3LUP3 · AlphaFold monomer V2.0 prediction for pre-pro-metalloprotease prtv (C3LUP3) · a predicted model of the same protein · chain A against A, TM-score 0.97

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