2025-02-08_00000210|ligand|9CD0

Crystal structure of the Klebsiella pneumoniae LpxH / JH-LPH-106 complex; X-ray diffraction 1.72Å
Protein #1 259 residues (93% resolved)

MATLFIADLHLQTEEPAITAGFLRFLQGEARQADALYILGDLFEAWIGDDDPNPLHQQIASAIKAVVDAGVPCYFIHGNRDFLVGQRFARQSGMILLAEEERLDLYGREVLIMHGDTLCTDDQGYLAFRAKVHTPWIQRLFLALPLFIRHRIAARMRADSKAANSSKSMEIMDVNPQAVVDAMERHHVQWLIHGHTHRPAVHELQANGQPAWRVVLGAWHSEGSMVKVTPDDVELIHFPFLEENLYFQSHHHHHHHHHH

MATLFIADLHLQTEEPAITAGFLRFLQGEARQADALYILGDLFEAWIGDDDPNPLHQQIASAIKAVVDAGVPCYFIHGNRDFLVGQRFARQSGMILLAEEERLDLYGREVLIMHGDTLCTDDQGYLAFRAKVHTPWIQRLFLALPLFIRHRIAARMRADSKAANSSKSMEIMDVNPQAVVDAMERHHVQWLIHGHTHRPAVHELQANGQPAWRVVLGAWHSEGSMVKVTPDDVELIHFPFLEENLYFQSHHHHHHHHHH
Non polymer #2 A1AVX

InChI=1S/C27H27ClF3N5O5S2/c1-33(42(2,38)39)23-6-4-3-5-21(23)26(37)36-10-9-18-15-20(7-8-22(18)36)43(40,41)35-13-11-34(12-14-35)25-17-19(27(29,30)31)16-24(28)32-25/h3-8,15-17H,9-14H2,1-2H3

CN(c1ccccc1C(=O)N2CCc3c2ccc(c3)S(=O)(=O)N4CCN(CC4)c5cc(cc(n5)Cl)C(F)(F)F)S(=O)(=O)C
Non polymer #3 MN

InChI=1S/Mn/q+2

[Mn+2]
Non polymer #4 PEG

InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

C(COCCO)O
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Reference