2026-10-17_00000161
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ligand
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9SXO
Crystal structure of ERK2 in complex with a ligand;
X-ray diffraction 1.44Å
Protein #1
364 residues (94% resolved)
Raw Sequence ...
HHHHHHMAAAAAAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNLNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHI(CME)YFLYQILRGLKYIHSANVLHRDLKPSNLLLNTT(CME)DLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLN(CME)IINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS
Canonical Sequence ...
HHHHHHMAAAAAAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNLNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS
Non polymer #2
A1JRO
InChI=1S/C18H17N5O3S/c1-27(25,26)23-17-7-16(21-22-17)15-9-20-18-14(15)6-13(8-19-18)12-4-2-11(10-24)3-5-12/h2-9,24H,10H2,1H3,(H,19,20)(H2,21,22,23)
InChI=1S/C18H17N5O3S/c1-27(25,26)23-17-7-16(21-22-17)15-9-20-18-14(15)6-13(8-19-18)12-4-2-11(10-24)3-5-12/h2-9,24H,10H2,1H3,(H,19,20)(H2,21,22,23)
SMILES: CS(=O)(=O)Nc1cc(n[nH]1)c2c[nH]c3c2cc(cn3)c4ccc(cc4)CO
CS(=O)(=O)Nc1cc(n[nH]1)c2c[nH]c3c2cc(cn3)c4ccc(cc4)CO
Non polymer #3
DMS
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
SMILES: CS(=O)C
CS(=O)C
Biounit #1
monomer
Download coordinates
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Model
Reference
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