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Crystal structure of wt rntmm

Analyse Crystal structure of wt rntmm in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5IPY
Type
protein
Length
890 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Flavin-containing monooxygenase
UniProt
A3SLM3
Ligands
NAP, FAD
Pockets
11 · best druggability 0.91

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BFlavin-containing monooxygenaseprotein44530% helix, 20% strandA3SLM3

Ligands and binding sites

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate · ligand · 2 copies · chains A, B
  • FAD · Flavin-adenine dinucleotide · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110920.910.94137FAD
22850.830.9450empty
32050.600.8125empty
41270.470.7824empty
5580.430.8316empty

Interfaces

1 interface between chains.

  • A–B · 1817 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 5IPY · Crystal structure of WT RnTmm · the same entry in another collection · chain A against A, TM-score 1.00

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