2026-08-29_00000237
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ligand
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9WI1
Crystal structure of LmrR with a covalent secondary amine bound to Cystein on position 57;
X-ray diffraction 2.95Å
Protein #1
131 residues (84% resolved)
Raw Sequence ...
GAEIPKEMLRAQTNVILLNVLKQGDNYVYGIIKQVKEASNGEMELNEATLYTIFDRCEQDGIISSYWGDESQGGRRKYYRLTEIGHEAMRLAFESWSRVDKIIENLEANKKSEAIKSRGGSGGWSHPQFEK
Canonical Sequence ...
GAEIPKEMLRAQTNVILLNVLKQGDNYVYGIIKQVKEASNGEMELNEATLYTIFDRCEQDGIISSYWGDESQGGRRKYYRLTEIGHEAMRLAFESWSRVDKIIENLEANKKSEAIKSRGGSGGWSHPQFEK
Non polymer #2
A1EWH
InChI=1S/C4H9NS/c6-4-1-2-5-3-4/h4-6H,1-3H2/t4-/m0/s1
InChI=1S/C4H9NS/c6-4-1-2-5-3-4/h4-6H,1-3H2/t4-/m0/s1
SMILES: C1CNC[C@H]1S
C1CNC[C@H]1S
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Biounit #1
homo-dimer
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Model
Reference
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