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MolNFT v1 · #164086 · protein

Structure of HPV49 E6 protein in complex with MAML1 lxxll motif

6SMV · MALTOSE/MALTODEXTRIN-binding periplasmic PROTEIN,PROTEIN…: “Structure of HPV49 E6 protein in complex with MAML1 lxxll motif”. X-ray diffraction, 2 ligands (GLC, ZN), 4 pockets (best druggability 0.74). MolNFT v1 #164086 on…

PDB
6SMV
Type
protein
Length
525 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MALTOSE/MALTODEXTRIN-binding periplasmic PROTEIN,PROTEIN E6,MASTERMIND-like protein 1
UniProt
P0AEX9, P36813, Q92585
Ligands
GLC, ZN
Pockets
4 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMALTOSE/MALTODEXTRIN-binding periplasmic PROTEIN,PROTEIN E6,MASTERMIND-like protein 1protein52543% helix, 18% strandP0AEX9, P36813, Q92585

Ligands and binding sites

  • GLC · alpha-D-glucopyranose · sugar · 4 copies · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13850.740.8536GLC
2500.710.9817empty
33650.580.7647empty
4500.300.7615empty

Compared structures

  • 6SMV · Structure of HPV49 E6 protein in complex with MAML1 LxxLL motif · the same entry in another collection · chain A against A, TM-score 1.00
  • Q92585 · AlphaFold monomer V2.0 prediction for mastermind-like protein 1 (Q92585) · a predicted model of the same protein · chain A against A, TM-score 0.18

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