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MolNFT v1 · #48161 · protein

Crystal structure of the human clp-36 (PDLIM1) bound to the C-terminal peptide of human alpha-actinin-1

2PKT · PDZ and lim domain protein 1: “Crystal structure of the human clp-36 (PDLIM1) bound to the C-terminal peptide of human alpha-actinin-1”. X-ray diffraction, 2 ligands (CA, CL), 1 pocket (best druggability 0.32). MolNFT v1 #48161 on…

PDB
2PKT
Type
protein
Length
91 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PDZ and lim domain protein 1
UniProt
O00151
Ligands
CA, CL
Pockets
1 · best druggability 0.32

Structure

x-ray diffraction · 1 distinct chain · 18% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APDZ and lim domain protein 1protein9118% helix, 43% strandO00151

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A
  • CL · Chloride ion · ion · chains A
  • ACT · Acetate ion · additive · chains A
  • PG4 · Tetraethylene glycol · additive · chains A
  • PEG · Di(hydroxyethyl)ether · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1640.320.7613empty

Compared structures

  • 2PKT · Crystal structure of the human CLP-36 (PDLIM1) bound to the C-terminal peptide of human… · the same entry in another collection · chain A against A, TM-score 1.00
  • O00151 · AlphaFold monomer V2.0 prediction for PDZ and lim domain protein 1 (O00151) · a predicted model of the same protein · chain A against A, TM-score 0.91

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