2024-10-05_00000080|hard|8WCI

Cryo-EM structure of the inhibitor-bound Vo complex from Enterococcus hirae; Electron microscopy 2.20Å
Protein #1 156 residues (100% resolved)

MMDYLITQNGGMVFAVLAMATATIFSGIGSAKGVGMTGEAAAALTTSQPEKFGQALILQLLPGTQGLYGFVIAFLIFINLGSDMSVVQGLNFLGASLPIAFTGLFSGIAQGKVAAAGIQILAKKPEHATKGIIFAAMVETYAILGFVISFLLVLNA

MMDYLITQNGGMVFAVLAMATATIFSGIGSAKGVGMTGEAAAALTTSQPEKFGQALILQLLPGTQGLYGFVIAFLIFINLGSDMSVVQGLNFLGASLPIAFTGLFSGIAQGKVAAAGIQILAKKPEHATKGIIFAAMVETYAILGFVISFLLVLNA
Protein #2 672 residues (51% resolved)

MAVTKMEKVTLISDKKNREILLQAVQGLHAVEIRDLFQESENNQWVETFFPEPEMIDKDKELAKLSYKLTDIRTAIQFIEHHGEKSQKKQHLKRRELSLDTLEKNYSEEAFSKKLEEVLLLKEQWEQLVDERQQLEDQENWLLNWQNLDLAPKAFDSQMTKLVIGTVNAKNAESFKAEVAEINEAYLEEINSSPTTTYFAYIVLRADESRMEEIASRYGFVKEDYLYEGTPQQQLVAAKQSLQEIKDQQKKLSSAIGACSGYIKDFEWTEEIFLARSEREAIKDRIIHTPYLILIQGWVDHEEKQELIHMLQNILASEEVYLTFDEPTDNEIAEEVPTKLKNHPIVAPFEMLTEMYSLPKYEEVDPTPWMMPFYLVFFGMMVADIGYGLLMFLGAFLLQKLVVLPRGMQRFAKFFEILAIPSIIWGFIYSSFFGAALPKEIFGIHLPFPILSTTDDVNTILILSVIFGLIQILVGLFIAAKEHIKRKAYVDAVNDGFAWQGILLGIILILLGTMILKNNAFVYLGGALAVLSAVCILIIPVFQSSSKAKGIAKGAYNLYGLTGYIGDLVSYTRLMALGISGGSIAAAFNMLVAFMPPAARFSVGILLIIVLQALNMFLTLLSAYVHGARLQYVEFFGKFYTGGGRSFKPLKTVEKYVNINHKKKEHLYFQGG

MAVTKMEKVTLISDKKNREILLQAVQGLHAVEIRDLFQESENNQWVETFFPEPEMIDKDKELAKLSYKLTDIRTAIQFIEHHGEKSQKKQHLKRRELSLDTLEKNYSEEAFSKKLEEVLLLKEQWEQLVDERQQLEDQENWLLNWQNLDLAPKAFDSQMTKLVIGTVNAKNAESFKAEVAEINEAYLEEINSSPTTTYFAYIVLRADESRMEEIASRYGFVKEDYLYEGTPQQQLVAAKQSLQEIKDQQKKLSSAIGACSGYIKDFEWTEEIFLARSEREAIKDRIIHTPYLILIQGWVDHEEKQELIHMLQNILASEEVYLTFDEPTDNEIAEEVPTKLKNHPIVAPFEMLTEMYSLPKYEEVDPTPWMMPFYLVFFGMMVADIGYGLLMFLGAFLLQKLVVLPRGMQRFAKFFEILAIPSIIWGFIYSSFFGAALPKEIFGIHLPFPILSTTDDVNTILILSVIFGLIQILVGLFIAAKEHIKRKAYVDAVNDGFAWQGILLGIILILLGTMILKNNAFVYLGGALAVLSAVCILIIPVFQSSSKAKGIAKGAYNLYGLTGYIGDLVSYTRLMALGISGGSIAAAFNMLVAFMPPAARFSVGILLIIVLQALNMFLTLLSAYVHGARLQYVEFFGKFYTGGGRSFKPLKTVEKYVNINHKKKEHLYFQGG
Non polymer #3 CDL

InChI=1S/C81H158O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-78(83)91-71-76(97-80(85)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-95-99(87,88)93-69-75(82)70-94-100(89,90)96-74-77(98-81(86)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4)72-92-79(84)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h75-77,82H,5-74H2,1-4H3,(H,87,88)(H,89,90)/p-2/t76-,77-/m1/s1

CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC(COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)O)OC(=O)CCCCCCCCCCCCCCCCC
Non polymer #4 NA

InChI=1S/Na/q+1

[Na+]
Non polymer #5 W3K

InChI=1S/C16H17N3/c1-11-4-9-14-15(10-11)18-16(17-14)12-5-7-13(8-6-12)19(2)3/h4-10H,1-3H3,(H,17,18)

Cc1ccc2c(c1)nc([nH]2)c3ccc(cc3)N(C)C
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Reference