2025-10-25_00000020
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ligand
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9D2U
Crystal structure of KPC-2 complexed with compound 14;
X-ray diffraction 1.57Å
Protein #1
290 residues (93% resolved)
Raw Sequence ...
MGSSHHHHHHSSGLVPRGSHMLTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSAIPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDKHSEAVIAAAARLALEGLGVNGQ
Canonical Sequence ...
MGSSHHHHHHSSGLVPRGSHMLTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSAIPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDKHSEAVIAAAARLALEGLGVNGQ
Non polymer #2
A1A18
InChI=1S/C15H18FN2O5P/c1-17-13-8-14(18-2-4-23-5-3-18)12(16)7-11(13)10(6-15(17)19)9-24(20,21)22/h6-8H,2-5,9H2,1H3,(H2,20,21,22)
InChI=1S/C15H18FN2O5P/c1-17-13-8-14(18-2-4-23-5-3-18)12(16)7-11(13)10(6-15(17)19)9-24(20,21)22/h6-8H,2-5,9H2,1H3,(H2,20,21,22)
SMILES: CN1c2cc(c(cc2C(=CC1=O)CP(=O)(O)O)F)N3CCOCC3
CN1c2cc(c(cc2C(=CC1=O)CP(=O)(O)O)F)N3CCOCC3
Biounit #1
monomer
Download coordinates
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Model
Reference
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