GL1X · GenesisL1 explorer

MolNFT v1 · #150754 · protein

Yeast 20S proteasome in complex with the peptidic non-covalent binding inhibitor rts-V5

6H39: “Yeast 20S proteasome in complex with the peptidic non-covalent binding inhibitor rts-V5”. X-ray diffraction, 4 ligands (FGY, MG, CL). MolNFT v1 #150754 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6H39
Type
protein
Length
6,336 residues
Chains
28
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P23639, P23638, P40303, P32379, P40302, P21242, P21243, P25043, P25451, P22141, P30656, P23724, P30657, P38624
Ligands
FGY, MG, CL, SO4

Structure

x-ray diffraction · 14 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, O—protein250—P23639
B, P—protein244—P23638
C, Q—protein240—P40303
D, R—protein235—P32379
E, S—protein231—P40302
F, T—protein243—P21242
G, U—protein241—P21243
H, V—protein222—P25043
I, W—protein204—P25451
J, X—protein195—P22141
K, Y—protein212—P30656
L, Z—protein222—P23724
M, a—protein233—P30657
N, b—protein196—P38624

Ligands and binding sites

  • FGY · N-(2,2-dimethylpropyl)-N~2~-[4-(hydroxycarbamoyl) benzene-1-carbonyl]-L-asparaginyl-N-benzyl-L-alaninamide · ligand · 2 copies · chains K, L, Y, Z
  • MG · Magnesium ion · metal · 10 copies · chains G, I, K, W, N, a, L, V, X, Y, Z
  • CL · Chloride ion · ion · 2 copies · chains G, H, U, V
  • SO4 · Sulfate ion · ion · 2 copies · chains N, b
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 2 copies · chains K, Y

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

Compared structures

  • 6H39 · Yeast 20S proteasome in complex with the peptidic non-covalent binding inhibitor RTS-V5 · the same entry in another collection · chain B against B, TM-score 1.00

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