2026-11-07_00000099|ligand|36JS

Tri-complex of RMC-0708, KRas Q61H, and CypA; X-ray diffraction 1.75Å
Protein #1 170 residues (100% resolved)

SMTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGHEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK

SMTEYKLVVVGAGGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGHEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK
Protein #2 166 residues (99% resolved)

SMVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE

SMVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE
Non polymer #3 A1DJS

InChI=1S/C62H79F3N8O9/c1-35(2)53-55(74)67-49-24-37-22-40(25-43(23-37)81-30-51-44(56(75)69(53)7)17-21-71(51)59(78)61(6)33-80-34-61)39-11-14-50-45(26-39)47(28-60(4,5)32-82-58(77)48-10-9-18-73(68-48)57(49)76)54(72(50)31-62(63,64)65)46-27-41(29-66-52(46)36(3)79-8)38-15-19-70(20-16-38)42-12-13-42/h11,14,22-23,25-27,29,35-36,38,42,44,48-49,51,53,68H,9-10,12-13,15-21,24,28,30-34H2,1-8H3,(H,67,74)/t36-,44-,48-,49-,51+,53-/m0/s1

C[C@@H](c1c(cc(cn1)C2CCN(CC2)C3CC3)c4c5c6cc(ccc6n4CC(F)(F)F)-c7cc8cc(c7)OC[C@@H]9[C@H](CCN9C(=O)C1(COC1)C)C(=O)N([C@H](C(=O)N[C@@H](C8)C(=O)N1CCC[C@H](N1)C(=O)OCC(C5)(C)C)C(C)C)C)OC
Non polymer #4 CL

InChI=1S/ClH/h1H/p-1

[Cl-]
Non polymer #5 GNP

InChI=1S/C10H17N6O13P3/c11-10-13-7-4(8(19)14-10)12-2-16(7)9-6(18)5(17)3(28-9)1-27-32(25,26)29-31(23,24)15-30(20,21)22/h2-3,5-6,9,17-18H,1H2,(H,25,26)(H3,11,13,14,19)(H4,15,20,21,22,23,24)/t3-,5-,6-,9-/m1/s1

c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@](=O)(O)O[P@@](=O)(NP(=O)(O)O)O)O)O)N=C(NC2=O)N
Non polymer #6 MG

InChI=1S/Mg/q+2

[Mg+2]
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Reference