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Crystal structure of patoxp, a cysteine protease-like domain of photorhabdus asymbiotica toxin patox

Analyse Crystal structure of patoxp, a cysteine protease-like domain of photorhabdus… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6HV6
Type
protein
Length
293 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Toxin PAU_02230
EC
2.4.1.-, 3.5.1.44
UniProt
C7BKP9
Pockets
2 · best druggability 0.31

Structure

x-ray diffraction · 1 distinct chain · 53% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AToxin PAU_02230 (EC 2.4.1.-, 3.5.1.44)protein29353% helix, 16% strandC7BKP9

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 6 copies · chains A
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1590.310.7618empty
2560.270.7311empty

Compared structures

  • 6HV6 · Crystal structure of PatoxP, a cysteine protease-like domain of Photorhabdus asymbiotica… · the same entry in another collection · chain A against A, TM-score 1.00

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