2026-01-24_00000110|ligand|9KJL

The mTREX1-NSC 37204 complex structure by soaking in Soaking Condition 3 (NSC 37204 complex 2); X-ray diffraction 1.70Å
Protein #1 252 residues (91% resolved)

MGSSHHHHHHSSGLVPRGSHMQTLIFLDLEATGLPSSRPEVTELCLLAVHRRALENTSISQGHPPPVPRPPRVVDKLSLCIAPGKACSPGASEITGLSKAELEVQGRQRFDDNLAILLRAFLQRQPQPCCLVAHNGDRYDFPLLQTELARLSTPSPLDGTFCVDSIAALKALEQASSPSGNGSRKSYSLGSIYTRLYWQAPTDSHTAEGDVLTLLSICQWKPQALLQWVDEHARPFSTVKPMYGTPATTGTT

MGSSHHHHHHSSGLVPRGSHMQTLIFLDLEATGLPSSRPEVTELCLLAVHRRALENTSISQGHPPPVPRPPRVVDKLSLCIAPGKACSPGASEITGLSKAELEVQGRQRFDDNLAILLRAFLQRQPQPCCLVAHNGDRYDFPLLQTELARLSTPSPLDGTFCVDSIAALKALEQASSPSGNGSRKSYSLGSIYTRLYWQAPTDSHTAEGDVLTLLSICQWKPQALLQWVDEHARPFSTVKPMYGTPATTGTT
Non polymer #2 A1L5Z

InChI=1S/C21H16N2O9S2/c24-19-9-15(33(27,28)29)5-11-1-3-13(7-17(11)19)22-21(26)23-14-4-2-12-6-16(34(30,31)32)10-20(25)18(12)8-14/h1-10,24-25H,(H2,22,23,26)(H,27,28,29)(H,30,31,32)

c1cc(cc2c1cc(cc2O)S(=O)(=O)O)NC(=O)Nc3ccc4cc(cc(c4c3)O)S(=O)(=O)O
Non polymer #3 NH4

InChI=1S/H3N/h1H3/p+1

[NH4+]
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Reference