2026-01-24_00000112|ligand|9KJN

The mTREX1-NSC 37215 complex structure by co-crystallization (NSC 37215-1 Complex 1); X-ray diffraction 1.70Å
Protein #1 252 residues (91% resolved)

MGSSHHHHHHSSGLVPRGSHMQTLIFLDLEATGLPSSRPEVTELCLLAVHRRALENTSISQGHPPPVPRPPRVVDKLSLCIAPGKACSPGASEITGLSKAELEVQGRQRFDDNLAILLRAFLQRQPQPCCLVAHNGDRYDFPLLQTELARLSTPSPLDGTFCVDSIAALKALEQASSPSGNGSRKSYSLGSIYTRLYWQAPTDSHTAEGDVLTLLSICQWKPQALLQWVDEHARPFSTVKPMYGTPATTGTT

MGSSHHHHHHSSGLVPRGSHMQTLIFLDLEATGLPSSRPEVTELCLLAVHRRALENTSISQGHPPPVPRPPRVVDKLSLCIAPGKACSPGASEITGLSKAELEVQGRQRFDDNLAILLRAFLQRQPQPCCLVAHNGDRYDFPLLQTELARLSTPSPLDGTFCVDSIAALKALEQASSPSGNGSRKSYSLGSIYTRLYWQAPTDSHTAEGDVLTLLSICQWKPQALLQWVDEHARPFSTVKPMYGTPATTGTT
Non polymer #2 A1L50

InChI=1S/C24H18N2O6S/c27-22-14-20(33(30,31)32)13-17-12-19(10-11-21(17)22)26-24(29)16-6-8-18(9-7-16)25-23(28)15-4-2-1-3-5-15/h1-14,27H,(H,25,28)(H,26,29)(H,30,31,32)

c1ccc(cc1)C(=O)Nc2ccc(cc2)C(=O)Nc3ccc4c(c3)cc(cc4O)S(=O)(=O)O
Non polymer #3 DMS

InChI=1S/C2H6OS/c1-4(2)3/h1-2H3

CS(=O)C
Non polymer #4 MG

InChI=1S/Mg/q+2

[Mg+2]
Non polymer #5 SIN

InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)

C(CC(=O)O)C(=O)O
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