GL1X · GenesisL1 explorer

Ligand · A60

A60 · (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(1S,2R)-3-{[(4-aminophenyl)sulfonyl](2-ethylbutyl)amino}-1-benzyl-2-hydroxypropyl]carbamate

A60, (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(1S,2R)-3-{[(4-aminophenyl)sulfonyl](2-ethylbutyl)amino}-1-benzyl-2-hydroxypropyl]carbamate (C29 H41 N3 O7 S, 575.7 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (5 PDB…

Component
A60
Formula
C29 H41 N3 O7 S
Class
ligand
Structures
6
PDB entries
5

Binding sites

A60 in 6 structures; the first of them:

  • 6DH2 · Crystal structure of HIV-1 Protease NL4-3 I84V Mutant in complex with UMass6 · A60 A102 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP29, ASP30, VAL32 and 23 more
  • 6DGZ · Crystal structure of HIV-1 protease NL4-3 wt in complex with UMASS6 · A60 A102 · binds ARG8, ASP25, GLY27, ALA28, ASP30, VAL32, ILE47, GLY48 and 17 more
  • 6DH2 · Crystal structure of HIV-1 protease NL4-3 I84V mutant in complex with UMASS6 · A60 A102 · binds ASP25, GLY27, ALA28, ASP30, VAL32, ILE47, GLY48, GLY49 and 14 more
  • 6DH5 · Crystal structure of HIV-1 protease NL4-3 V82I mutant in complex with UMASS6 · A60 A104 · binds ASP25, GLY27, ALA28, ASP30, VAL32, ILE47, GLY48, GLY49 and 18 more
  • 6DH8 · Crystal structure of HIV-1 protease NL4-3 I50V mutant in complex with UMASS6 · A60 A105 · binds ARG8, LEU23, ASP25, GLY27, ALA28, ASP30, VAL32, ILE47 and 17 more
  • 6W6R · Wt HTLV-1 protease in complex with UMASS6 (UM6) · A60 A201 · binds ARG10, ASP32, GLY34, ALA35, ASP36, MET37, LEU57, ALA59 and 16 more

Residues it binds most

GLY 6, ASP 6, ILE 6, VAL 6, ALA 6, LEU 5, PRO 5, ARG 4, MET 1, THR 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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