Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T12837 | Target Info | |||
| Target Name | Histone-arginine methyltransferase CARM1 (CARM1) | ||||
| Synonyms | Protein arginine N-methyltransferase 4; PRMT4; Histonearginine methyltransferase CARM1; Coactivatorassociated arginine methyltransferase 1; Coactivator-associated arginine methyltransferase 1 | ||||
| Target Type | Literature-reported Target | ||||
| Gene Name | CARM1 | ||||
| Biochemical Class | Methyltransferase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Tilarginine | Ligand Info | |||
| Canonical SMILES | CN=C(N)NCCCC(C(=O)O)N | ||||
| InChI | 1S/C7H16N4O2/c1-10-7(9)11-4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H,12,13)(H3,9,10,11)/t5-/m0/s1 | ||||
| InChIKey | NTNWOCRCBQPEKQ-YFKPBYRVSA-N | ||||
| PubChem Compound ID | 132862 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5DX8 Crystal structure of CARM1, sinefungin, and methylated PABP1 peptide (R455) | ||||||
| Method | X-ray diffraction | Resolution | 1.94 Å | Mutation | Yes | [1] |
| PDB Sequence |
RSVFSERTEE
143 SSAVQYFQFY153 GYLSQQQNMM163 QDYVRTGTYQ173 RAILQNHTDF183 KDKIVLDVGC 193 GSGILSFFAA203 QAGARKIYAV213 EASTMAQHAE223 VLVKSNNLTD233 RIVVIPGKVE 243 EVSLPEQVDI253 IISEPMGYML263 FNERMLESYL273 HAKKYLKPSG283 NMFPTIGDVH 293 LAPFTDEQLY303 MEQFTKANFW313 YQPSFHGVDL323 SALRGAAVDE333 YFRQPVVDTF 343 DIRILMAKSV353 KYTVNFLEAK363 EGDLHRIEIP373 FKFHMLHSGL383 VHGLAFWFDV 393 AFIGSIMTVW403 LSTAPTEPLT413 HWYQVRCLFQ423 SPLFAKAGDT433 LSGTCLLIAN 443 KRQSYDISIV453 AQVDQTGSKS463 SNLLDLKNPF473 FRYT
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| PDB ID: 5DXA Crystal structure of CARM1, sinefungin, and methylated PABP1 peptide (R460) | ||||||
| Method | X-ray diffraction | Resolution | 2.07 Å | Mutation | Yes | [1] |
| PDB Sequence |
RSVFSERTEE
143 SSAVQYFQFY153 GYLSQQQNMM163 QDYVRTGTYQ173 RAILQNHTDF183 KDKIVLDVGC 193 GSGILSFFAA203 QAGARKIYAV213 EASTMAQHAE223 VLVKSNNLTD233 RIVVIPGKVE 243 EVSLPEQVDI253 IISEPMGYML263 FNERMLESYL273 HAKKYLKPSG283 NMFPTIGDVH 293 LAPFTDEQLY303 MEQFTKANFW313 YQPSFHGVDL323 SALRGAAVDE333 YFRQPVVDTF 343 DIRILMAKSV353 KYTVNFLEAK363 EGDLHRIEIP373 FKFHMLHSGL383 VHGLAFWFDV 393 AFIGSIMTVW403 LSTAPTEPLT413 HWYQVRCLFQ423 SPLFAKAGDT433 LSGTCLLIAN 443 KRQSYDISIV453 AQVDQTGSKS463 SNLLDLKNPF473 FRYT
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structural Insights into Ternary Complex Formation of Human CARM1 with Various Substrates. ACS Chem Biol. 2016 Mar 18;11(3):763-71. | ||||
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