2024-06-08_00000068
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ligand
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8P8F
Crystal structure of the lipase SpL from Sphingomonas sp. HXN-200 in complex with N-benzyl-picolinamide;
X-ray diffraction 1.80Å
Protein #1
329 residues (94% resolved)
Raw Sequence ...
MGSSHHHHHHSQDPMTDSTTHYTRPDVAAFLAFLNAQEGPKMEEMPPAGAREMMRVMGQLADVPRGEIAKVEDRMIPGPDGDIPIRLYDNRPDREAGPVMVFYHGGGWVIGDLETHDPYCAEAARILDMPVIAIDYRLAPEHPFPAAPIDCEAATRWVADNIACTGLVLSGDSAGGNLTIVTALALRDEPAAKPVIAIHPIYPAVTTHNDWQSYRDFGEGHLLTEGSMTWFGNHYAADPADRRAAPIDFPADGLPPTLLITASLDPLRDQGRAYAAKLIEAGVPTTYREAKGTIHGYICLAQGIPSAKDDIRGALTVLKAIVAEATGAA
Canonical Sequence ...
MGSSHHHHHHSQDPMTDSTTHYTRPDVAAFLAFLNAQEGPKMEEMPPAGAREMMRVMGQLADVPRGEIAKVEDRMIPGPDGDIPIRLYDNRPDREAGPVMVFYHGGGWVIGDLETHDPYCAEAARILDMPVIAIDYRLAPEHPFPAAPIDCEAATRWVADNIACTGLVLSGDSAGGNLTIVTALALRDEPAAKPVIAIHPIYPAVTTHNDWQSYRDFGEGHLLTEGSMTWFGNHYAADPADRRAAPIDFPADGLPPTLLITASLDPLRDQGRAYAAKLIEAGVPTTYREAKGTIHGYICLAQGIPSAKDDIRGALTVLKAIVAEATGAA
Non polymer #2
XBW
InChI=1S/C13H12N2O/c16-13(12-8-4-5-9-14-12)15-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16)
InChI=1S/C13H12N2O/c16-13(12-8-4-5-9-14-12)15-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16)
SMILES: c1ccc(cc1)CNC(=O)c2ccccn2
c1ccc(cc1)CNC(=O)c2ccccn2
Biounit #1
homo-dimer
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Model
Reference
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