3OAM

crystal structure of cytidylyltransferase from vibrio cholerae

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 110
  • Norm. En. per Res.: -3.7848
• Hub Node: A(2)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-65.6741	73.4653	-411.409	-403.6177	111	11	14	15789	0	32	41
A-D	-7.9131	0.4091	-47.2476	-54.7516	41	4	0	2101	0	10	11
B-C	-24.5068	0.0	-47.0746	-71.5814	39	4	0	1871	0	12	11
B-D	-16.2989	-18.2727	-61.7727	-96.3444	56	5	0	2725	2	16	18
C-D	-66.5454	63.1857	-412.963	-416.3228	110	11	13	15972	0	31	42

Interface residues

• A-B: ALA141A, ALA141B, ALA152A, ALA152B, ALA158A, ALA158B, ALA168A, ALA168B, ARG157A, ARG157B, ARG164A, ARG164B, ARG213A, ARG213B, ASN140A, ASN140B, ASN166A, ASN166B, ASP147A, ASP147B, ASP163A, ASP163B, ASP165A, ASP165B, CYS208A, CYS208B, GLN176A, GLN176B, GLN199A, GLN199B, GLN202A, GLN202B, GLU204A, GLU204B, GLU207A, GLU207B, GLU219A, GLU219B, GLY150A, GLY150B, GLY218A, GLY218B, HIS217A, HIS217B, ILE145A, ILE145B, ILE160A, ILE160B, ILE206A, ILE206B, LEU153A, LEU153B, LEU178A, LEU178B, LEU179A, LEU179B, LEU203A, LEU203B, LEU209A, LEU209B, LEU212A, LEU212B, LEU215A, LEU215B, LYS148A, LYS148B, LYS172A, LYS205A, LYS205B, LYS220A, LYS220B, PHE137A, PHE137B, PHE155A, PHE155B, PHE167A, PHE167B, PRO139A, PRO139B, PRO161A, PRO161B, PRO177A, PRO177B, SER149A, SER149B, SER156A, SER156B, SER201A, SER201B, THR146A, THR146B, THR159A, THR159B, TRP162A, TRP162B, TRP198A, TRP198B, TRP216A, TRP216B, TYR151A, TYR151B, TYR154A, TYR154B, VAL142A, VAL142B, VAL144A, VAL144B, VAL175A, VAL175B, VAL214A, VAL214B
• A-D: ALA117A, ALA118A, ALA121A, ALA84D, ALA87D, ALA90D, ARG188A, ARG44D, ASN115A, ASN193D, ASP147A, ASP43D, ASP91D, CYS119A, GLN59D, GLU219A, GLY150A, GLY190D, GLY218A, HIS222A, HIS92D, ILE46D, ILE88D, LEU116A, LYS148A, LYS220A, LYS85D, MET1A, MET86D, PRO122A, PRO89D, SER120A, SER149A, SER2D, THR194D, THR4D, TYR151A, VAL64D, VAL82D, VAL83D, VAL94D
• B-C: ALA117C, ALA118C, ALA121C, ALA84B, ALA87B, ALA90B, ARG188C, ARG44B, ASN115C, ASN193B, ASP147C, ASP43B, ASP91B, ASP91C, CYS119C, GLN59B, GLU219C, GLY150C, GLY218C, HIS222C, HIS92B, ILE46B, ILE88B, LEU116C, LYS148C, LYS220C, LYS85B, MET1C, MET86B, PRO122C, PRO89B, SER120C, SER149C, SER2B, THR4B, TYR151C, VAL64B, VAL82B, VAL83B
• B-D: ALA117B, ALA117D, ALA118B, ALA118D, ALA121B, ALA121D, ALA189B, ALA189D, ALA90B, ALA90D, ARG188B, ARG188D, ASN193B, ASP147D, ASP197B, ASP197D, ASP91B, ASP91D, CYS119B, CYS119D, GLU219B, GLU219D, GLY190B, GLY190D, GLY218B, GLY218D, HIS217B, HIS217D, HIS92B, HIS92D, ILE88B, ILE88D, ILE93B, ILE93D, LEU116B, LEU116D, LEU215B, LYS220B, LYS220D, PHE191B, PHE191D, PRO122B, PRO122D, PRO89B, PRO89D, SER120B, SER120D, THR194B, THR194D, TRP198B, TRP198D, TRP216B, TYR151B, TYR151D, VAL214B, VAL214D
• C-D: ALA152C, ALA152D, ALA158C, ALA158D, ALA168C, ALA168D, ARG157C, ARG157D, ARG164C, ARG164D, ARG213C, ARG213D, ASN140C, ASN140D, ASN166C, ASN166D, ASP147C, ASP147D, ASP163C, ASP163D, ASP165C, ASP165D, CYS208C, CYS208D, GLN176C, GLN176D, GLN199C, GLN199D, GLN202C, GLN202D, GLU204C, GLU204D, GLU207C, GLU207D, GLU219C, GLU219D, GLY150C, GLY150D, GLY218C, GLY218D, HIS217C, HIS217D, ILE145C, ILE145D, ILE160C, ILE160D, ILE206C, ILE206D, LEU153C, LEU153D, LEU178C, LEU178D, LEU179C, LEU179D, LEU203C, LEU203D, LEU209C, LEU209D, LEU212C, LEU212D, LEU215C, LEU215D, LYS143D, LYS148C, LYS148D, LYS172C, LYS205C, LYS205D, LYS220C, LYS220D, PHE137C, PHE137D, PHE155C, PHE155D, PHE167C, PHE167D, PRO139C, PRO139D, PRO161C, PRO161D, PRO177C, PRO177D, SER149C, SER149D, SER156C, SER156D, SER201C, SER201D, THR146C, THR146D, THR159C, THR159D, TRP162C, TRP162D, TRP198C, TRP198D, TRP216C, TRP216D, TYR151C, TYR151D, TYR154C, TYR154D, VAL142C, VAL142D, VAL144C, VAL144D, VAL175C, VAL175D, VAL214C, VAL214D