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Crystal structure of the C2B domain of trypanosoma brucei extended synaptotagmin (E-syt)

Analyse Crystal structure of the C2B domain of trypanosoma brucei extended… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7A1R
Type
protein
Length
242 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Synaptotagmin
UniProt
A0A3L6KWL9
Ligands
CA, NA, CL
Pockets
2 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 7% helix, 55% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BSynaptotagminprotein1217% helix, 55% strandA0A3L6KWL9

Ligands and binding sites

  • CA · Calcium ion · metal · 4 copies · chains A, B
  • NA · Sodium ion · metal · chains A
  • CL · Chloride ion · ion · 7 copies · chains A, B
  • ACT · Acetate ion · additive · chains B

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11260.450.7718CL
21190.430.7619empty

Interfaces

1 interface between chains.

  • A–B · 580 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 7A1R · Crystal structure of the C2B domain of Trypanosoma brucei extended synaptotagmin (E-Syt) · the same entry in another collection · chain A against A, TM-score 1.00

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