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MolNFT v1 · #10880 · protein

The crystal structure of ca+-bound human S100P determined at 2.0A resolution by X-ray

1J55 · S-100P protein: “The crystal structure of ca+-bound human S100P determined at 2.0A resolution by X-ray”. X-ray diffraction, 1 ligand (CA), 1 pocket (best druggability 0.33). MolNFT v1 #10880 on GenesisL1: 3D structure, binding sites…

PDB
1J55
Type
protein
Length
88 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
S-100P protein
UniProt
P25815
Ligands
CA
Pockets
1 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 66% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AS-100P proteinprotein8866% helix, 5% strandP25815

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · 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
1580.330.7611empty

Compared structures

  • 1J55 · The Crystal Structure of Ca+-bound Human S100P Determined at 2.0A Resolution by X-ray · the same entry in another collection · chain A against A, TM-score 1.00
  • P25815 · AlphaFold monomer V2.0 prediction for protein S100-P (P25815) · a predicted model of the same protein · chain A against A, TM-score 0.95

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