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Human centrin 2 xeroderma pigmentosum group C protein complex

Analyse Human centrin 2 xeroderma pigmentosum group C protein complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2GGM
Type
protein
Length
327 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Centrin-2; DNA-repair protein complementing xp-C cells
UniProt
P41208, Q01831
Ligands
CA
Pockets
5 · best druggability 0.45

Structure

x-ray diffraction · 3 distinct chains · 64% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACentrin-2protein14961% helix, 5% strandP41208
BCentrin-2protein14463% helix, 6% strandP41208
C, DDNA-repair protein complementing xp-C cellsprotein1788% helix, 0% strandQ01831

Ligands and binding sites

  • CA · Calcium ion · metal · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11340.450.7720empty
21610.450.7518empty
31400.450.7623empty
4630.420.8112empty
5640.320.7511empty

Interfaces

6 interfaces between chains.

  • A–C · 877 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 812 Ų buried · 6 hydrogen bonds · protein-protein
  • C–D · 308 Ų buried · 0 hydrogen bonds · protein-protein
  • B–C · 168 Ų buried · 2 hydrogen bonds · protein-protein
  • A–D · 105 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 14 modified (engineered).

Compared structures

  • 2GGM · Human centrin 2 xeroderma pigmentosum group C protein complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P41208 · AlphaFold monomer V2.0 prediction for centrin-2 (P41208) · a predicted model of the same protein · chain B against A, TM-score 0.91
  • Q01831 · AlphaFold monomer V2.0 prediction for DNA repair protein complementing xp-C cells (Q01831) · a predicted model of the same protein · chain C against A, TM-score 0.74

Analyse

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