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Crystal structure of the C-terminal domain of ypbh

Analyse Crystal structure of the C-terminal domain of ypbh in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3JTO
Type
protein
Length
550 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adapter protein meca 2
UniProt
P50734
Pockets
5 · best druggability 0.58

Structure

x-ray diffraction · 5 distinct chains · 42% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DAdapter protein meca 2protein9443% helix, 31% strandP50734
BAdapter protein meca 2protein9043% helix, 24% strandP50734
CAdapter protein meca 2protein9245% helix, 32% strandP50734
EAdapter protein meca 2protein8940% helix, 24% strandP50734
FAdapter protein meca 2protein9140% helix, 24% strandP50734

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11030.580.8518empty
22000.570.8030empty
32290.550.7841empty
42530.490.7433empty
51130.340.7224empty

Interfaces

8 interfaces between chains.

  • C–D · 549 Ų buried · 13 hydrogen bonds · protein-protein
  • E–F · 541 Ų buried · 7 hydrogen bonds · protein-protein
  • A–B · 531 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 432 Ų buried · 11 hydrogen bonds · protein-protein
  • D–F · 337 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 3JTO · Crystal structure of the c-terminal domain of YpbH · the same entry in another collection · chain F against F, TM-score 1.00
  • P50734 · AlphaFold monomer V2.0 prediction for adapter protein meca 2 (P50734) · a predicted model of the same protein · chain B against A, TM-score 0.98

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