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First bromo-adjacent homology (bah) domain of human polybromo-1 (PBRM1)

Analyse First bromo-adjacent homology (bah) domain of human polybromo-1 (PBRM1) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6OXB
Type
protein
Length
947 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein polybromo-1
UniProt
Q86U86
Ligands
SO4, CL
Pockets
15 · best druggability 0.79

Structure

x-ray diffraction · 4 distinct chains · 8% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
B, A, FProtein polybromo-1protein1588% helix, 51% strandQ86U86
CProtein polybromo-1protein1598% helix, 48% strandQ86U86
DProtein polybromo-1protein1578% helix, 50% strandQ86U86
EProtein polybromo-1protein1578% helix, 50% strandQ86U86

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 30 copies · chains B, A, C, F, D, E
  • CL · Chloride ion · ion · 2 copies · chains B, A, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15530.790.8558empty
25310.790.8653empty
34770.790.8652empty
48430.710.7675empty
54320.650.7839empty

Interfaces

8 interfaces between chains.

  • D–E · 830 Ų buried · 8 hydrogen bonds · protein-protein
  • C–F · 795 Ų buried · 6 hydrogen bonds · protein-protein
  • B–A · 786 Ų buried · 8 hydrogen bonds · protein-protein
  • A–F · 306 Ų buried · 1 hydrogen bond · protein-protein
  • A–E · 98 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 6OXB · First bromo-adjacent homology (BAH) domain of human Polybromo-1 (PBRM1) · the same entry in another collection · chain F against F, TM-score 1.00
  • Q86U86 · AlphaFold monomer V2.0 prediction for protein polybromo-1 (Q86U86) · a predicted model of the same protein · chain E against A, TM-score 0.98

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