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MolNFT v1 · #189594 · protein

Cryo-EM structures of listeria monocytogenes man-pts

7VLX · MANNOSE/FRUCTOSE/SORBOSE family pts transporter subunit iic: “Cryo-EM structures of listeria monocytogenes man-pts”. Electron microscopy, 1 ligand (MAN), 20 pockets (best druggability 0.88). MolNFT v1 #189594 on GenesisL1: 3D…

PDB
7VLX
Type
protein
Length
1,635 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MANNOSE/FRUCTOSE/SORBOSE family pts transporter subunit iic; Pts mannose family…
UniProt
S5LAD9, A0A1E8EBU8
Ligands
MAN
Pockets
20 · best druggability 0.88

Structure

electron microscopy · 2 distinct chains · 64% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
Y, A, CMANNOSE/FRUCTOSE/SORBOSE family pts transporter subunit iicprotein24768% helix, 0% strandS5LAD9
Z, B, DPts mannose family transporter subunit iidprotein29860% helix, 3% strandA0A1E8EBU8

Ligands and binding sites

  • MAN · alpha-D-mannopyranose · sugar · 3 copies · chains Y, Z, A, B, C, D

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

Pockets

20 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14360.880.9440empty
25980.700.7864empty
33530.640.7938empty
42850.630.8028empty
53760.600.7653empty

Interfaces

12 interfaces between chains.

  • C–D · 4805 Ų buried · 31 hydrogen bonds · protein-protein
  • Y–Z · 4798 Ų buried · 29 hydrogen bonds · protein-protein
  • A–B · 4751 Ų buried · 32 hydrogen bonds · protein-protein
  • Y–A · 660 Ų buried · 4 hydrogen bonds · protein-protein
  • Y–C · 653 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 7VLX · Cryo-EM structures of Listeria monocytogenes man-PTS · the same entry in another collection · chain Y against Y, TM-score 1.00

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