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MolNFT v1 · #151976 · protein

Helical MYD88 death domain filament

6I3N · Myeloid differentiation primary response protein MYD88: “Helical MYD88 death domain filament”. Electron microscopy, 20 pockets (best druggability 0.69). MolNFT v1 #151976 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6I3N
Type
protein
Length
1,339 residues
Chains
13
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myeloid differentiation primary response protein MYD88
UniProt
H0Y4G9
Pockets
20 · best druggability 0.69

Structure

electron microscopy · 1 distinct chain · 64% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
M, I, J, K, H, L, B, F, C, D, A, E, GMyeloid differentiation primary response protein MYD88protein10364% helix, 0% strandH0Y4G9

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14870.690.8054empty
22980.670.8362empty
33980.640.7941empty
42620.630.8147empty
52190.620.8238empty

Interfaces

31 interfaces between chains.

  • K–H · 673 Ų buried · 10 hydrogen bonds · protein-protein
  • J–G · 671 Ų buried · 10 hydrogen bonds · protein-protein
  • D–G · 667 Ų buried · 11 hydrogen bonds · protein-protein
  • F–C · 664 Ų buried · 11 hydrogen bonds · protein-protein
  • H–E · 664 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 6I3N · Helical MyD88 death domain filament · the same entry in another collection · chain M against M, TM-score 1.00

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