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MolNFT v1 · #114948 · protein

Crystal structure of putative tetr family transcription factor from listeria monocytogenes

5C4Y · Putative transcription regulator LMO0852: “Crystal structure of putative tetr family transcription factor from listeria monocytogenes”. X-ray diffraction, 5 pockets (best druggability 0.75). MolNFT v1 #114948 on GenesisL1: 3D…

PDB
5C4Y
Type
protein
Length
272 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative transcription regulator LMO0852
UniProt
Q8Y8P4
Pockets
5 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 82% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPutative transcription regulator LMO0852protein13682% helix, 0% strandQ8Y8P4

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11190.750.9424empty
21550.660.8735empty
3700.420.8014empty
4750.360.7612empty
5500.270.7414empty

Interfaces

1 interface between chains.

  • A–B · 1260 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (engineered).

Compared structures

  • 5C4Y · Crystal structure of putative TetR family transcription factor from Listeria monocytogenes · the same entry in another collection · chain A against A, TM-score 1.00

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