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Crystal structure of porb from neisseria meningitidis in complex with cesium ion, space group P63

Analyse Crystal structure of porb from neisseria meningitidis in complex with cesium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3VY8
Type
protein
Length
341 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Outer membrane protein
Ligands
CS
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 59% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XOuter membrane proteinprotein3416% helix, 59% strand—

Ligands and binding sites

  • CS · Cesium ion · metal · 3 copies · chains X

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18510.690.7683CS
21240.650.8824empty
32050.460.7433empty
41180.380.7418empty

Compared structures

  • 3VY8 · Crystal Structure of PorB from Neisseria meningitidis in complex with Cesium ion, space… · the same entry in another collection · chain X against X, TM-score 1.00

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