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MolNFT v1 · #163214 · protein

Cryo-EM structure of photorhabdus luminescens TCDA1

6RW6: “Cryo-EM structure of photorhabdus luminescens TCDA1”. Electron microscopy, 20 pockets (best druggability 0.86). MolNFT v1 #163214 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6RW6
Type
protein
Length
12,425 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TCDA1
UniProt
Q9RN43
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 1 distinct chain · 43% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, ETCDA1protein248543% helix, 18% strandQ9RN43

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19190.860.88114empty
29070.860.88122empty
38310.860.88100empty
48750.850.8796empty
58460.850.8794empty

Interfaces

10 interfaces between chains.

  • A–B · 12181 Ų buried · 135 hydrogen bonds · protein-protein
  • B–C · 12105 Ų buried · 122 hydrogen bonds · protein-protein
  • A–E · 12096 Ų buried · 128 hydrogen bonds · protein-protein
  • D–E · 12095 Ų buried · 129 hydrogen bonds · protein-protein
  • C–D · 12088 Ų buried · 128 hydrogen bonds · protein-protein

Compared structures

  • 6RW6 · Cryo-EM structure of Photorhabdus luminescens TcdA1 · the same entry in another collection · chain A against A, TM-score 1.00

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