2025-12-13_00000270
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ligand
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9VRS
Crystal structure of human PTPN2 with inhibitor WS19;
X-ray diffraction 2.00Å
Protein #1
301 residues (99% resolved)
Raw Sequence ...
GPLGSPWGSIEREFEELDTQRRWQPLYLEIRNESHDYPHRVAKFPENRNRNRYRDVSPYDHSRVKLQNAENDYINASLVDIEEAQRSYILTQGPLPNTCCHFWLMVWQQKTKAVVMLNRIVEKESVKCAQYWPTDDQEMLFKETGFSVKLLSEDVKSYYTVHLLQLENINSGETRTISHFHYTTWPDFGVPESPASFLNFLFKVRESGSLNPDHGPAVIHCSAGIGRSGTFSLVDTCLVLMEKGDDINIKQVLLNMRKYRMGLIQTPDQLRFSYMAIIEGAKCIKGDSSIQKRWKELSKED
Canonical Sequence ...
GPLGSPWGSIEREFEELDTQRRWQPLYLEIRNESHDYPHRVAKFPENRNRNRYRDVSPYDHSRVKLQNAENDYINASLVDIEEAQRSYILTQGPLPNTCCHFWLMVWQQKTKAVVMLNRIVEKESVKCAQYWPTDDQEMLFKETGFSVKLLSEDVKSYYTVHLLQLENINSGETRTISHFHYTTWPDFGVPESPASFLNFLFKVRESGSLNPDHGPAVIHCSAGIGRSGTFSLVDTCLVLMEKGDDINIKQVLLNMRKYRMGLIQTPDQLRFSYMAIIEGAKCIKGDSSIQKRWKELSKED
Non polymer #2
A1ETK
InChI=1S/C15H15FN4O4S/c16-11-5-9(10-7-17-19-4-2-1-3-12(10)19)6-13(21)15(11)20-8-14(22)18-25(20,23)24/h5-7,21H,1-4,8H2,(H,18,22)
InChI=1S/C15H15FN4O4S/c16-11-5-9(10-7-17-19-4-2-1-3-12(10)19)6-13(21)15(11)20-8-14(22)18-25(20,23)24/h5-7,21H,1-4,8H2,(H,18,22)
SMILES: c1c(cc(c(c1O)N2CC(=O)NS2(=O)=O)F)c3cnn4c3CCCC4
c1c(cc(c(c1O)N2CC(=O)NS2(=O)=O)F)c3cnn4c3CCCC4
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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