2026-09-05_00000232
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ligand
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9WL4
Crystal structure of human glutaminyl cyclase in complex with Inhibitor CL20;
X-ray diffraction 2.44Å
Protein #1
361 residues (89% resolved)
Raw Sequence ...
MAGGRHRRVVGTLHLLLLVAALPWASRGVSPSASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL
Canonical Sequence ...
MAGGRHRRVVGTLHLLLLVAALPWASRGVSPSASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL
Non polymer #2
A1EXQ
InChI=1S/C18H19N3O3/c1-12-9-19-11-21(12)10-13-7-8-15(18(22)20-13)14-5-4-6-16(23-2)17(14)24-3/h4-9,11H,10H2,1-3H3,(H,20,22)
InChI=1S/C18H19N3O3/c1-12-9-19-11-21(12)10-13-7-8-15(18(22)20-13)14-5-4-6-16(23-2)17(14)24-3/h4-9,11H,10H2,1-3H3,(H,20,22)
SMILES: Cc1cncn1CC2=CC=C(C(=O)N2)c3cccc(c3OC)OC
Cc1cncn1CC2=CC=C(C(=O)N2)c3cccc(c3OC)OC
Non polymer #3
MG
InChI=1S/Mg/q+2
InChI=1S/Mg/q+2
SMILES: [Mg+2]
[Mg+2]
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
homo-hexamer
Download coordinates
Biounit #2
homo-hexamer
Download coordinates
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Model
Reference
100%