1LB1

crystal structure of the dbl and pleckstrin homology domains of dbs in complex with rhoa

• Total interactions analyzed: 28
• Total true interactions: 6
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 159
  • Norm. En. per Res.: -3.3624
• Hub Node: C(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	-43.8142	-41.7751	-393.456	-479.0454	157	17	9	16907	6	55	48
C-D	-52.2877	-43.7047	-414.695	-510.6875	158	14	9	17174	6	55	48
C-E	-2.8972	-5.4307	-41.9454	-50.2733	59	54	1	4153	0	15	17
D-G	-22.47	-5.3098	-38.1677	-65.9476	29	3	2	2133	0	10	8
E-F	-54.1179	-44.9171	-435.589	-534.624	159	24	9	17747	6	56	53
G-H	-34.4282	-38.0449	-391.239	-463.7121	156	22	9	16869	7	59	50

Interface residues

• A-B: ALA15B, ALA3B, ALA44B, ALA56B, ALA61B, ALA646A, ALA808A, ALA817A, ALA886A, ARG5B, ARG633A, ARG634A, ARG68B, ARG70B, ARG734A, ARG740A, ARG771A, ARG876A, ASN109B, ASN41B, ASN638A, ASN731A, ASN810A, ASN879A, ASP45B, ASP59B, ASP642A, ASP65B, ASP67B, ASP756A, ASP762A, ASP76B, ASP811A, CYS107B, CYS729A, GLN63B, GLN730A, GLN749A, GLN752A, GLN770A, GLN776A, GLN834A, GLU32B, GLU40B, GLU54B, GLU639A, GLU644A, GLU64B, GLU650A, GLU726A, GLU736A, GLU781A, GLU877A, GLU878A, GLU881A, GLU884A, GLY14B, GLY62B, GLY804A, GLY835A, GLY880A, GLY882A, HIS105B, HIS635A, HIS757A, HIS814A, HIS862A, ILE23B, ILE631A, ILE772A, ILE802A, ILE805A, ILE816A, ILE818A, LEU22B, LEU55B, LEU57B, LEU632A, LEU640A, LEU69B, LEU72B, LEU759A, LEU761A, LEU765A, LEU766A, LEU777A, LEU778A, LEU779A, LEU803A, LEU806A, LEU815A, LEU8B, LYS104B, LYS18B, LYS6B, LYS732A, LYS753A, LYS758A, LYS767A, LYS774A, LYS780A, LYS784A, LYS7B, LYS807A, LYS875A, LYS885A, MET637A, MET782A, MET813A, PHE106B, PHE39B, PHE864A, PRO108B, PRO36B, PRO71B, PRO733A, PRO75B, PRO768A, PRO887A, SER628A, SER735A, SER737A, SER73B, SER743A, SER760A, SER763A, SER812A, SER836A, SER888A, THR19B, THR37B, THR60B, THR643A, THR773A, TRP58B, TRP739A, TYR34B, TYR42B, TYR647A, TYR66B, TYR725A, TYR728A, TYR74B, TYR764A, TYR775A, TYR785A, TYR883A, TYR889A, VAL33B, VAL35B, VAL38B, VAL43B, VAL636A, VAL648A, VAL769A, VAL809A, VAL9B
• C-D: ALA15D, ALA3D, ALA44D, ALA56D, ALA61D, ALA646C, ALA808C, ALA817C, ALA886C, ARG5D, ARG633C, ARG634C, ARG68D, ARG70D, ARG734C, ARG740C, ARG771C, ARG876C, ASN109D, ASN41D, ASN638C, ASN731C, ASN810C, ASN879C, ASP45D, ASP59D, ASP642C, ASP65D, ASP67D, ASP756C, ASP762C, ASP76D, ASP811C, CYS107D, CYS729C, GLN63D, GLN730C, GLN749C, GLN752C, GLN770C, GLN776C, GLN834C, GLU32D, GLU40D, GLU54D, GLU639C, GLU644C, GLU64D, GLU650C, GLU726C, GLU736C, GLU781C, GLU877C, GLU878C, GLU881C, GLU884C, GLU97D, GLY14D, GLY62D, GLY804C, GLY835C, GLY880C, GLY882C, HIS105D, HIS635C, HIS757C, HIS814C, HIS862C, ILE23D, ILE631C, ILE772C, ILE802C, ILE805C, ILE816C, ILE818C, LEU22D, LEU55D, LEU57D, LEU632C, LEU640C, LEU69D, LEU72D, LEU759C, LEU761C, LEU765C, LEU766C, LEU777C, LEU778C, LEU779C, LEU803C, LEU806C, LEU815C, LYS104D, LYS18D, LYS6D, LYS732C, LYS753C, LYS758C, LYS767C, LYS774C, LYS780C, LYS784C, LYS7D, LYS807C, LYS875C, LYS885C, MET637C, MET782C, MET813C, PHE106D, PHE39D, PHE864C, PRO108D, PRO36D, PRO71D, PRO733C, PRO75D, PRO768C, PRO887C, PRO929C, SER628C, SER735C, SER737C, SER73D, SER743C, SER760C, SER763C, SER812C, SER836C, SER888C, THR19D, THR37D, THR60D, THR643C, THR773C, TRP58D, TRP739C, TYR34D, TYR42D, TYR647C, TYR66D, TYR725C, TYR728C, TYR74D, TYR764C, TYR775C, TYR785C, TYR883C, TYR889C, VAL33D, VAL35D, VAL38D, VAL43D, VAL636C, VAL648C, VAL769C, VAL809C, VAL9D
• C-E: ALA869C, ALA869E, ALA899C, ALA899E, ALA919C, ALA919E, ALA951C, ALA951E, ARG920C, ARG920E, ARG953C, ARG953E, ASN824C, ASN896C, ASN896E, ASN918C, ASN918E, ASP822C, ASP822E, CYS952C, CYS952E, GLN893E, GLN948C, GLN948E, GLN950C, GLN950E, GLU921C, GLU921E, GLU922E, GLY820C, GLY820E, GLY823C, LEU828C, LEU895C, LEU895E, LEU945E, LEU949C, LEU949E, LYS844C, LYS844E, LYS845C, LYS845E, LYS868C, MET897C, SER894C, SER894E, SER947E, THR898C, THR898E, THR946E, TRP916C, TRP916E, TYR821C, TYR891C, TYR891E, TYR917C, TYR917E, VAL900C, VAL900E
• D-G: ALA132D, ALA668G, ARG128D, ARG129D, ASN664G, ASN677G, ASP663G, GLN136D, GLN676G, GLU125D, GLU137D, GLY674G, HIS669G, ILE671G, LEU131D, LEU666G, LEU670G, LEU675G, LYS133D, LYS135D, LYS140D, MET134D, MET662G, MET667G, PRO138D, PRO665G, PRO746G, SER672G, THR673G
• E-F: ALA15F, ALA3F, ALA44F, ALA56F, ALA61F, ALA646E, ALA808E, ALA817E, ALA886E, ARG5F, ARG633E, ARG634E, ARG645E, ARG68F, ARG70F, ARG734E, ARG740E, ARG771E, ARG876E, ASN109F, ASN41F, ASN638E, ASN731E, ASN810E, ASN879E, ASP45F, ASP59F, ASP642E, ASP65F, ASP67F, ASP756E, ASP762E, ASP76F, ASP811E, CYS107F, CYS729E, GLN63F, GLN730E, GLN749E, GLN752E, GLN770E, GLN776E, GLN834E, GLU32F, GLU40F, GLU54F, GLU639E, GLU644E, GLU64F, GLU650E, GLU726E, GLU736E, GLU781E, GLU877E, GLU878E, GLU881E, GLU884E, GLU97F, GLY14F, GLY62F, GLY804E, GLY835E, GLY880E, GLY882E, HIS105F, HIS635E, HIS757E, HIS814E, HIS862E, ILE23F, ILE631E, ILE772E, ILE802E, ILE805E, ILE816E, ILE818E, LEU22F, LEU55F, LEU57F, LEU632E, LEU640E, LEU69F, LEU72F, LEU759E, LEU761E, LEU765E, LEU766E, LEU777E, LEU778E, LEU779E, LEU803E, LEU806E, LEU815E, LYS104F, LYS18F, LYS6F, LYS732E, LYS753E, LYS758E, LYS767E, LYS774E, LYS780E, LYS784E, LYS7F, LYS807E, LYS875E, LYS885E, MET637E, MET782E, MET813E, PHE106F, PHE39F, PHE864E, PRO108F, PRO36F, PRO71F, PRO733E, PRO75F, PRO768E, PRO887E, PRO929E, SER628E, SER735E, SER737E, SER73F, SER743E, SER760E, SER763E, SER812E, SER836E, SER888E, THR19F, THR37F, THR60F, THR643E, THR773E, TRP58F, TRP739E, TYR34F, TYR42F, TYR647E, TYR66F, TYR725E, TYR728E, TYR74F, TYR764E, TYR775E, TYR785E, TYR883E, TYR889E, VAL33F, VAL35F, VAL38F, VAL43F, VAL636E, VAL648E, VAL769E, VAL809E, VAL9F
• G-H: ALA15H, ALA3H, ALA44H, ALA56H, ALA61H, ALA646G, ALA808G, ALA817G, ALA886G, ARG5H, ARG633G, ARG634G, ARG645G, ARG68H, ARG70H, ARG734G, ARG740G, ARG771G, ARG876G, ASN109H, ASN41H, ASN638G, ASN731G, ASN810G, ASN879G, ASP45H, ASP59H, ASP642G, ASP65H, ASP67H, ASP756G, ASP762G, ASP76H, ASP811G, CYS107H, CYS729G, GLN63H, GLN730G, GLN749G, GLN752G, GLN770G, GLN776G, GLN834G, GLU32H, GLU40H, GLU54H, GLU639G, GLU644G, GLU64H, GLU650G, GLU726G, GLU736G, GLU781G, GLU877G, GLU878G, GLU881G, GLU884G, GLY14H, GLY62H, GLY804G, GLY835G, GLY880G, GLY882G, HIS105H, HIS635G, HIS757G, HIS814G, HIS862G, ILE23H, ILE631G, ILE772G, ILE802G, ILE805G, ILE816G, ILE818G, LEU22H, LEU55H, LEU57H, LEU632G, LEU640G, LEU69H, LEU72H, LEU759G, LEU761G, LEU765G, LEU766G, LEU777G, LEU778G, LEU779G, LEU803G, LEU806G, LEU815G, LEU8H, LYS104H, LYS18H, LYS6H, LYS732G, LYS753G, LYS758G, LYS767G, LYS774G, LYS780G, LYS784G, LYS7H, LYS807G, LYS875G, LYS885G, MET637G, MET782G, MET813G, PHE106H, PHE39H, PHE864G, PRO108H, PRO36H, PRO71H, PRO733G, PRO75H, PRO887G, SER628G, SER735G, SER73H, SER743G, SER760G, SER763G, SER812G, SER836G, SER888G, THR19H, THR37H, THR60H, THR643G, THR773G, TRP58H, TRP739G, TYR34H, TYR42H, TYR647G, TYR66H, TYR725G, TYR728G, TYR74H, TYR764G, TYR775G, TYR785G, TYR883G, TYR889G, VAL33H, VAL35H, VAL38H, VAL43H, VAL636G, VAL648G, VAL769G, VAL809G, VAL9H