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MolNFT v1 · #166119 · protein

Katanin hexamer in the spiral conformation in complex with substrate

6UGD · Meiotic spindle formation protein mei-1: “Katanin hexamer in the spiral conformation in complex with substrate”. Electron microscopy, 2 ligands (ATP, MG), 20 pockets (best druggability 0.82). MolNFT v1 #166119 on GenesisL1: 3D…

PDB
6UGD
Type
protein
Length
1,865 residues
Chains
7
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Meiotic spindle formation protein mei-1; Polyglutamate peptide
EC
5.6.1.1
UniProt
P34808
Ligands
ATP, MG
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 7 distinct chains · 40% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein30543% helix, 6% strandP34808
BMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein30538% helix, 7% strandP34808
CMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein30839% helix, 7% strandP34808
DMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein31041% helix, 7% strandP34808
EMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein31243% helix, 9% strandP34808
FMeiotic spindle formation protein mei-1 (EC 5.6.1.1)protein31138% helix, 8% strandP34808
GPolyglutamate peptideprotein140% helix, 36% strand—

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 6 copies · chains A, B, C, D, E, F
  • MG · Magnesium ion · metal · 5 copies · chains A, B, C, D, E

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

Pockets

20 pockets found on a 1 Å grid, 18 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110570.820.83109empty
210220.790.81112ATP, MG
310930.790.8094ATP, MG
411370.790.80113ATP, MG
57980.770.8198ATP, MG

Interfaces

14 interfaces between chains.

  • D–E · 2233 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 2199 Ų buried · 20 hydrogen bonds · protein-protein
  • A–B · 2197 Ų buried · 16 hydrogen bonds · protein-protein
  • E–F · 2162 Ų buried · 13 hydrogen bonds · protein-protein
  • B–C · 2124 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 6UGD · Katanin hexamer in the spiral conformation in complex with substrate · the same entry in another collection · chain G against G, TM-score 1.00
  • P34808 · AlphaFold monomer V2.0 prediction for meiotic spindle formation protein mei-1 (P34808) · a predicted model of the same protein · chain C against A, TM-score 0.94

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