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Crystal structure of a survivin-borealin-incenp core complex

Analyse Crystal structure of a survivin-borealin-incenp core complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2QFA
Type
protein
Length
244 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Baculoviral iap repeat-containing protein 5; Borealin; Inner centromere protein
UniProt
O15392, Q53HL2, Q9NQS7
Ligands
ZN
Pockets
1 · best druggability 0.38

Structure

x-ray diffraction · 3 distinct chains · 67% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABaculoviral iap repeat-containing protein 5protein13753% helix, 8% strandO15392
BBorealinprotein6289% helix, 2% strandQ53HL2
CInner centromere proteinprotein4580% helix, 0% strandQ9NQS7

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • MES · 2-(N-morpholino)-ethanesulfonic acid · 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
1920.380.7620MES

Interfaces

3 interfaces between chains.

  • A–B · 1487 Ų buried · 21 hydrogen bonds · protein-protein
  • B–C · 1017 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 953 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2QFA · Crystal structure of a Survivin-Borealin-INCENP core complex · the same entry in another collection · chain A against A, TM-score 1.00
  • O15392 · AlphaFold monomer V2.0 prediction for baculoviral iap repeat- containing protein 5… · a predicted model of the same protein · chain A against A, TM-score 0.94
  • Q53HL2 · AlphaFold monomer V2.0 prediction for borealin (Q53HL2) · a predicted model of the same protein · chain B against A, TM-score 0.93
  • Q9NQS7 · AlphaFold monomer V2.0 prediction for inner centromere protein (Q9NQS7) · a predicted model of the same protein · chain C against A, TM-score 0.63

Analyse

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