2026-08-22_00000374
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ligand
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9RYL
METTL1 bound to the SAM competitive small molecule inhibitor STM9005;
X-ray diffraction 1.44Å
Protein #1
235 residues (91% resolved)
Raw Sequence ...
GDHTLRYPVKPEEMDWSELYPEFFAPLTQNQSHDDPKDKKEKRAQAQVEFADIGCGYGGLLVELSPLFPDTLILGLEIRVKVSDYVQDRIRALRAAPAGGFQNIACLRSNAMKHLPNFFYKGQLTKMFFLFPDPHFKRTKHKWRIISPTLLAEYAYVLRVGGLVYTITDVLELHDWMCTHFEEHPLFERVPLEDLSEDPVVGHLGTSTEEGKKVLRNGGKNFPAIFRRIQDPVLQ
Canonical Sequence ...
GDHTLRYPVKPEEMDWSELYPEFFAPLTQNQSHDDPKDKKEKRAQAQVEFADIGCGYGGLLVELSPLFPDTLILGLEIRVKVSDYVQDRIRALRAAPAGGFQNIACLRSNAMKHLPNFFYKGQLTKMFFLFPDPHFKRTKHKWRIISPTLLAEYAYVLRVGGLVYTITDVLELHDWMCTHFEEHPLFERVPLEDLSEDPVVGHLGTSTEEGKKVLRNGGKNFPAIFRRIQDPVLQ
Non polymer #2
A1JKJ
InChI=1S/C21H21Cl2N5O3/c1-11-18-12(6-13(22)7-14(18)23)2-3-28(11)20(29)17-10-27(4-5-30-17)16-9-25-8-15-19(16)31-21(24)26-15/h6-9,11,17H,2-5,10H2,1H3,(H2,24,26)/t11-,17+/m0/s1
InChI=1S/C21H21Cl2N5O3/c1-11-18-12(6-13(22)7-14(18)23)2-3-28(11)20(29)17-10-27(4-5-30-17)16-9-25-8-15-19(16)31-21(24)26-15/h6-9,11,17H,2-5,10H2,1H3,(H2,24,26)/t11-,17+/m0/s1
SMILES: C[C@H]1c2c(cc(cc2Cl)Cl)CCN1C(=O)[C@H]3CN(CCO3)c4cncc5c4oc(n5)N
C[C@H]1c2c(cc(cc2Cl)Cl)CCN1C(=O)[C@H]3CN(CCO3)c4cncc5c4oc(n5)N
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #4
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
monomer
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Model
Reference
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