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MolNFT v1 · #99234 · protein

Crystal structure of DXNB2, a carbon - carbon bond hydrolase from sphingomonas wittichii RW1

4LXG · Mcp hydrolase: “Crystal structure of DXNB2, a carbon - carbon bond hydrolase from sphingomonas wittichii RW1”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.73). MolNFT v1 #99234 on GenesisL1: 3D structure…

PDB
4LXG
Type
protein
Length
274 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mcp hydrolase
EC
3.7.1.8
UniProt
A5VAT9
Ligands
SO4
Pockets
2 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMcp hydrolase (EC 3.7.1.8)protein27443% helix, 19% strandA5VAT9

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 3 copies · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13020.730.8651SO4
2520.320.7716empty

Compared structures

  • 4LXG · Crystal structure of DxnB2, a carbon - carbon bond hydrolase from Sphingomonas wittichii… · the same entry in another collection · chain A against A, TM-score 1.00

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