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MolNFT v1 · #127198 · protein

26S proteasome in presence of ATP (S2)

5MPE · 26S proteasome regulatory subunit RPN10: “26S proteasome in presence of ATP (S2)”. Electron microscopy, 20 pockets (best druggability 0.84). MolNFT v1 #127198 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MPE
Type
protein
Length
5,142 residues
Chains
13
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
26S proteasome regulatory subunit RPN10; Ubiquitin carboxyl-terminal hydrolase RPN11; 26S…
EC
3.4.19.12
UniProt
P38886, P43588, P32496, O13563, O94742, P38764, P32565, P40016, Q12250, Q12377, Q06103, Q08723, Q04062
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 13 distinct chains · 62% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
W26S proteasome regulatory subunit RPN10protein19736% helix, 18% strandP38886
VUbiquitin carboxyl-terminal hydrolase RPN11 (EC 3.4.19.12)protein28946% helix, 16% strandP43588
T26S proteasome regulatory subunit RPN12protein26673% helix, 2% strandP32496
X26S proteasome regulatory subunit RPN13protein1279% helix, 28% strandO13563
Y26S proteasome complex subunit SEM1protein5165% helix, 0% strandO94742
Z26S proteasome regulatory subunit RPN1protein90659% helix, 2% strandP38764
N26S proteasome regulatory subunit RPN2protein89064% helix, 4% strandP32565
S26S proteasome regulatory subunit RPN3protein47569% helix, 2% strandP40016
P26S proteasome regulatory subunit RPN5protein44073% helix, 3% strandQ12250
Q26S proteasome regulatory subunit RPN6protein43471% helix, 3% strandQ12377
R26S proteasome regulatory subunit RPN7protein38173% helix, 3% strandQ06103
U26S proteasome regulatory subunit RPN8protein29848% helix, 18% strandQ08723
O26S proteasome regulatory subunit RPN9protein38870% helix, 4% strandQ04062

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14820.840.9076empty
211340.820.8398empty
38880.810.8392empty
48170.790.8272empty
51260.760.9523empty

Interfaces

27 interfaces between chains.

  • V–U · 4053 Ų buried · 23 hydrogen bonds · protein-protein
  • T–S · 2138 Ų buried · 22 hydrogen bonds · protein-protein
  • U–O · 1864 Ų buried · 15 hydrogen bonds · protein-protein
  • Y–S · 1648 Ų buried · 16 hydrogen bonds · protein-protein
  • Q–R · 1618 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 5MPE · 26S proteasome in presence of ATP (s2) · the same entry in another collection · chain N against N, TM-score 1.00

Analyse

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