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C.BCLI, control element of the bcli restriction-modification system

Analyse C.BCLI, control element of the bcli restriction-modification system in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2B5A
Type
protein
Length
304 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
C.BCLI
Pockets
4 · best druggability 0.62

Structure

x-ray diffraction · 3 distinct chains · 71% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AC.BCLIprotein7770% helix, 1% strand—
BC.BCLIprotein7572% helix, 1% strand—
C, DC.BCLIprotein7670% helix, 1% strand—

Ligands and binding sites

  • ACY · Acetic acid · additive · 2 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14400.620.7647empty
2950.440.7915empty
3950.430.7815empty
4840.410.7814empty

Interfaces

3 interfaces between chains.

  • A–B · 970 Ų buried · 12 hydrogen bonds · protein-protein
  • C–D · 939 Ų buried · 12 hydrogen bonds · protein-protein
  • B–C · 303 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 2B5A · C.BclI, Control Element of the BclI Restriction-Modification System · the same entry in another collection · chain A against A, TM-score 1.00

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