2025-09-06_00000156
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ligand
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9M7F
Crystal structure of AsDMS D333N mutant in complex with farnesyl pyrophosphate;
X-ray diffraction 2.60Å
Protein #1
521 residues (100% resolved)
Raw Sequence ...
GSHLTPELITSLQELSQILDRYDTIVFDLGDVLLHWDSVHFTSETKGIDDVRKMVKHPVWQDLEKGLINQEFALTALSCELETPCSKLKEMLELSIASLQVNPLMVEVLRVLHKKDKQIYCLSNVDLESFSYLYKQFDFWKYFDGIYVSALLQLRKPNPDIFQYLISSASINTKSTIFIDDKSENLQEAANFGISTLKYNKDNFEYTAIEGGWPIPLQNMTPEIHKKRTLGEDYLNLRLRKFPFCKSFVSNNVELIGGEDFSKEIFSTAVILHSYTSLPDDIIASMCHEILNHDGQNKLRWCFYKNEARPDNFPDDLNTTSMVLSFLLNHNKLTIEKIIPVAEQMIANRNEEGIIQVYFDDNRPRIDAIVAINVLYLMHQIGYGERKELKETEAFVFDFLISKEYLKGTRYYPAPDVFLFFLSRLVVDFPDQFEKFHKPLTEMLITRVNCSTFPLERALRIIALKKLGIVNRVDFLKLLDTQLADGGWPVYGLFIAPRSNTYFGSRELSTAFALEALHILS
Canonical Sequence ...
GSHLTPELITSLQELSQILDRYDTIVFDLGDVLLHWDSVHFTSETKGIDDVRKMVKHPVWQDLEKGLINQEFALTALSCELETPCSKLKEMLELSIASLQVNPLMVEVLRVLHKKDKQIYCLSNVDLESFSYLYKQFDFWKYFDGIYVSALLQLRKPNPDIFQYLISSASINTKSTIFIDDKSENLQEAANFGISTLKYNKDNFEYTAIEGGWPIPLQNMTPEIHKKRTLGEDYLNLRLRKFPFCKSFVSNNVELIGGEDFSKEIFSTAVILHSYTSLPDDIIASMCHEILNHDGQNKLRWCFYKNEARPDNFPDDLNTTSMVLSFLLNHNKLTIEKIIPVAEQMIANRNEEGIIQVYFDDNRPRIDAIVAINVLYLMHQIGYGERKELKETEAFVFDFLISKEYLKGTRYYPAPDVFLFFLSRLVVDFPDQFEKFHKPLTEMLITRVNCSTFPLERALRIIALKKLGIVNRVDFLKLLDTQLADGGWPVYGLFIAPRSNTYFGSRELSTAFALEALHILS
Non polymer #2
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #3
FPP
InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+
InChI=1S/C15H28O7P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-21-24(19,20)22-23(16,17)18/h7,9,11H,5-6,8,10,12H2,1-4H3,(H,19,20)(H2,16,17,18)/b14-9+,15-11+
SMILES: CC(=CCC/C(=C/CC/C(=C/CO[P@@](=O)(O)OP(=O)(O)O)/C)/C)C
CC(=CCC/C(=C/CC/C(=C/CO[P@@](=O)(O)OP(=O)(O)O)/C)/C)C
Non polymer #4
MES
InChI=1S/C6H13NO4S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h1-6H2,(H,8,9,10)
InChI=1S/C6H13NO4S/c8-12(9,10)6-3-7-1-4-11-5-2-7/h1-6H2,(H,8,9,10)
SMILES: C1COCC[NH+]1CCS(=O)(=O)[O-]
C1COCC[NH+]1CCS(=O)(=O)[O-]
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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