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Crystal structure of the MDC1 brct repeat in complex with the histone tail of gamma-H2AX

Analyse Crystal structure of the MDC1 brct repeat in complex with the histone tail of… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2AZM
Type
protein
Length
398 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mediator of DNA damage checkpoint protein 1; Gamma-H2AX histone
UniProt
Q14676
Pockets
1 · best druggability 0.48

Structure

x-ray diffraction · 3 distinct chains · 41% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMediator of DNA damage checkpoint protein 1protein19344% helix, 14% strandQ14676
BMediator of DNA damage checkpoint protein 1protein19540% helix, 13% strandQ14676
C, DGamma-H2AX histoneprotein50% helix, 20% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11270.480.7927empty

Interfaces

3 interfaces between chains.

  • A–B · 406 Ų buried · 6 hydrogen bonds · protein-protein
  • B–D · 371 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 371 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered, phosphorylation).

Compared structures

  • 2AZM · Crystal structure of the MDC1 brct repeat in complex with the histone tail of gamma-H2AX · the same entry in another collection · chain A against A, TM-score 1.00
  • Q14676 · AlphaFold monomer V2.0 prediction for mediator of DNA damage checkpoint protein 1 (Q14676) · a predicted model of the same protein · chain A against A, TM-score 0.98

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