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MolNFT v1 · #141290 · protein

Structure of dictyostelium discoideum mitochondrial calcium uniporter N-ternimal domain (se-ddmcu-ntd)

5Z2I: “Structure of dictyostelium discoideum mitochondrial calcium uniporter N-ternimal domain (se-ddmcu-ntd)”. X-ray diffraction, 7 pockets (best druggability 0.60). MolNFT v1 #141290 on GenesisL1: 3D structure, binding sites and pockets…

PDB
5Z2I
Type
protein
Length
371 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dictyostelium discoideum mitochondrial calcium uniporter
UniProt
Q54LT0
Pockets
7 · best druggability 0.60

Structure

x-ray diffraction · 3 distinct chains · 62% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DDictyostelium discoideum mitochondrial calcium uniporterprotein9262% helix, 9% strandQ54LT0
BDictyostelium discoideum mitochondrial calcium uniporterprotein9462% helix, 9% strandQ54LT0
CDictyostelium discoideum mitochondrial calcium uniporterprotein9362% helix, 9% strandQ54LT0

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14710.600.7553empty
22110.560.7927empty
31120.480.8014empty
41880.470.7523empty
5820.420.7918empty

Interfaces

4 interfaces between chains.

  • A–B · 1447 Ų buried · 20 hydrogen bonds · protein-protein
  • C–D · 1383 Ų buried · 17 hydrogen bonds · protein-protein
  • B–C · 221 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 17 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 5Z2I · Structure of Dictyostelium discoideum mitochondrial calcium uniporter N-ternimal domain… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q54LT0 · AlphaFold monomer V2.0 prediction for calcium uniporter protein, mitochondrial (Q54LT0) · a predicted model of the same protein · chain A against A, TM-score 0.91

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