2026-11-07_00000143|ligand|44HW

Crystal structure of human glutaminyl cyclase in complex with Inhibitor; X-ray diffraction 1.84Å
Protein #1 329 residues (98% resolved)

ASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL

ASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL
Non polymer #2 A1FDM

InChI=1S/C21H21F3N6O/c1-13-10-25-12-30(13)9-8-26-20-27-11-17(21(22,23)24)18(29-20)14-2-4-15(5-3-14)19(31)28-16-6-7-16/h2-5,10-12,16H,6-9H2,1H3,(H,28,31)(H,26,27,29)

Cc1cncn1CCNc2ncc(c(n2)c3ccc(cc3)C(=O)NC4CC4)C(F)(F)F
Non polymer #3 MG

InChI=1S/Mg/q+2

[Mg+2]
Non polymer #4 TRS

InChI=1S/C4H11NO3/c5-4(1-6,2-7)3-8/h6-8H,1-3,5H2/p+1

C(C(CO)(CO)[NH3+])O
Non polymer #5 ZN

InChI=1S/Zn/q+2

[Zn+2]
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Reference