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Knob domain from adenovirus serotype 12 in complex with domain 1 of its cellular receptor car

Analyse Knob domain from adenovirus serotype 12 in complex with domain 1 of its… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1KAC
Type
protein
Length
309 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (fiber knob protein); Protein (coxsackie virus and adenovirus receptor)
UniProt
P36711, P78310
Pockets
2 · best druggability 0.43

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein (fiber knob protein)protein18510% helix, 41% strandP36711
BProtein (coxsackie virus and adenovirus receptor)protein1247% helix, 48% strandP78310

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11470.430.7523empty
21600.420.7426empty

Interfaces

1 interface between chains.

  • A–B · 783 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1KAC · Knob domain from adenovirus serotype 12 in complex with domain 1 of its cellular receptor… · the same entry in another collection · chain A against A, TM-score 1.00
  • P78310 · AlphaFold monomer V2.0 prediction for coxsackievirus and adenovirus receptor (P78310) · a predicted model of the same protein · chain B against A, TM-score 0.94

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