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MolNFT v1 · #175627 · protein

Crystal structure of a novel cutinase from burkhoderiales bacterium RIFCSPLOWO2_02_FULL_57_36

7CWQ · Dlh domain-containing protein: “Crystal structure of a novel cutinase from burkhoderiales bacterium RIFCSPLOWO2_02_FULL_57_36”. X-ray diffraction, 1 ligand (SO4), 2 pockets (best druggability 0.66). MolNFT v1 #175627 on GenesisL1…

PDB
7CWQ
Type
protein
Length
540 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dlh domain-containing protein
UniProt
A0A1F4JXW8
Ligands
SO4
Pockets
2 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BDlh domain-containing proteinprotein27030% helix, 22% strandA0A1F4JXW8

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13680.660.8051empty
2630.630.9322empty

Interfaces

1 interface between chains.

  • A–B · 642 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7CWQ · Crystal structure of a novel cutinase from Burkhoderiales bacterium… · the same entry in another collection · chain A against A, TM-score 1.00

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