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MolNFT v1 · #59241 · protein

Crystal structure of monomine

3BS2 · Lipocalin: “Crystal structure of monomine”. X-ray diffraction, 1 pocket (best druggability 0.64). MolNFT v1 #59241 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3BS2
Type
protein
Length
146 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lipocalin
UniProt
Q09JX9
Pockets
1 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 15% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALipocalinprotein14615% helix, 40% strandQ09JX9

Ligands and binding sites

  • GOL · Glycerol · additive · 3 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11940.640.8435GOL

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 3BS2 · Crystal Structure of Monomine · the same entry in another collection · chain A against A, TM-score 1.00

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