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MolNFT v1 · #174505 · protein

Mavc-UBE2N-ub complex

7BXG: “Mavc-UBE2N-ub complex”. X-ray diffraction, 5 pockets (best druggability 0.78). MolNFT v1 #174505 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7BXG
Type
protein
Length
601 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Mavc; Ubiquitin-conjugating enzyme E2 N; Polyubiquitin-C
EC
2.3.2.23
UniProt
Q5ZTL4, P61088, P0CG48
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 3 distinct chains · 43% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMavcprotein37750% helix, 15% strandQ5ZTL4
BUbiquitin-conjugating enzyme E2 N (EC 2.3.2.23)protein15033% helix, 17% strandP61088
DPolyubiquitin-Cprotein7426% helix, 31% strandP0CG48

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110100.780.8082empty
210100.740.7795empty
32510.580.7838empty
4550.370.8013empty
5570.330.7716empty

Interfaces

3 interfaces between chains.

  • A–B · 1267 Ų buried · 7 hydrogen bonds · protein-protein
  • A–D · 1242 Ų buried · 24 hydrogen bonds · protein-protein
  • B–D · 202 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 isopeptide (isopeptide).

Compared structures

  • 7BXG · MavC-UBE2N-Ub complex · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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