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Crystal structure of a putative secreted protein (PA3611) from pseudomonas aeruginosa at 1.60 a resolution

Analyse Crystal structure of a putative secreted protein (PA3611) from pseudomonas… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3NPD
Type
protein
Length
113 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative secreted protein
UniProt
Q9HY15
Ligands
SO4
Pockets
1 · best druggability 0.29

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative secreted proteinprotein11345% helix, 30% strandQ9HY15

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • CXS · 3-cyclohexyl-1-propylsulfonic acid · additive · 4 copies · chains A
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1690.290.7315CXS

Modifications

Observed in the structure: 2 modified, 1 disulfide (engineered, disulfide).

Compared structures

  • 3NPD · Crystal structure of a putative secreted protein (PA3611) from PSEUDOMONAS AERUGINOSA at… · the same entry in another collection · chain A against A, TM-score 1.00

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