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MolNFT v1 · #22904 · protein

Crystallographic identification of CA2+ coordination sites in synaptotagmin I C2B domain

1TJX · Similar to SYNAPTOTAGMINI/P65: “Crystallographic identification of CA2+ coordination sites in synaptotagmin I C2B domain”. X-ray diffraction, 1 ligand (CA), 1 pocket (best druggability 0.45). MolNFT v1 #22904 on GenesisL1: 3D…

PDB
1TJX
Type
protein
Length
156 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Similar to SYNAPTOTAGMINI/P65
UniProt
P21707
Ligands
CA
Pockets
1 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 19% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASimilar to SYNAPTOTAGMINI/P65protein15619% helix, 44% strandP21707

Ligands and binding sites

  • CA · Calcium ion · metal · 2 copies · chains A
  • ACT · Acetate ion · additive · chains A
  • GOL · Glycerol · 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
1540.450.8419GOL

Compared structures

  • 1TJX · Crystallographic Identification of Ca2+ Coordination Sites in Synaptotagmin I C2B Domain · the same entry in another collection · chain A against A, TM-score 1.00
  • P21707 · AlphaFold monomer V2.0 prediction for synaptotagmin-1 (P21707) · a predicted model of the same protein · chain A against A, TM-score 0.95

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