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MolNFT v1 · #18644 · protein

Crystal structure of a conserved cbs domain protein TA0289 of unknown function from thermoplasma acidophilum

1PVM · Conserved hypothetical protein TA0289: “Crystal structure of a conserved cbs domain protein TA0289 of unknown function from thermoplasma acidophilum”. X-ray diffraction, 1 ligand (HG), 3 pockets (best druggability 0.79). MolNFT v1…

PDB
1PVM
Type
protein
Length
362 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Conserved hypothetical protein TA0289
UniProt
Q9HLD9
Ligands
HG
Pockets
3 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 32% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AConserved hypothetical protein TA0289protein17833% helix, 27% strandQ9HLD9
BConserved hypothetical protein TA0289protein18432% helix, 26% strandQ9HLD9

Ligands and binding sites

  • HG · Mercury (II) ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13980.790.8850empty
21010.480.8120empty
31170.460.7821empty

Interfaces

1 interface between chains.

  • A–B · 1875 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 1PVM · Crystal Structure of a Conserved CBS Domain Protein TA0289 of Unknown Function from… · the same entry in another collection · chain A against A, TM-score 1.00

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