3L48

crystal structure of the c-terminal domain of the papc usher

• Total interactions analyzed: 10
• Total true interactions: 9
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 32
  • Norm. En. per Res.: -3.7033
• Hub Node: A(4)

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	0.0	16.6525	-59.0041	-42.3516	32	3	0	2331	4	7	4
A-C	-17.4359	12.7162	-202.876	-207.5957	72	2	2	7462	0	10	9
A-D	-20.5893	0.0	-112.086	-132.6753	43	3	6	4433	0	4	6
A-E	-11.6001	-20.6553	-65.3005	-97.5559	36	2	0	2606	2	8	5
B-C	-9.5031	11.2893	-76.2247	-74.4384	37	8	3	2995	0	4	7
B-D	-22.6261	-24.0591	-71.8211	-118.5063	32	3	0	2787	4	9	6
B-E	-21.1301	36.9034	-122.356	-106.5827	45	7	4	5094	0	6	6
C-E	0.0	6.1284	-0.1806	5.9477	7	0	0	53	0	0	2
D-E	0.0	6.0208	-0.2056	5.8152	2	0	0	31	0	2	1

Interface residues

• A-B: ALA733A, ALA733B, ALA761A, ALA761B, ALA766B, ARG730A, ARG730B, ARG736B, ASP762B, ASP798A, ASP798B, GLN742B, GLN799A, GLN799B, GLN800A, GLN800B, GLU763A, GLU763B, ILE734A, ILE734B, LEU731A, LEU731B, LEU765A, LEU765B, LEU801A, LEU801B, PHE732A, PHE732B, SER797A, SER797B, TRP767A, TRP767B
• A-C: ALA733A, ALA733C, ALA738C, ALA747A, ALA761A, ALA766A, ALA795C, ARG730A, ARG736C, ARG755A, ASN790C, ASP739C, ASP762A, ASP798A, ASP798C, CYS787C, CYS805C, GLN742C, GLN788C, GLN799C, GLN800C, GLU756A, GLU763A, GLU775A, GLU793C, GLY740C, GLY746A, GLY754A, GLY758A, GLY770A, GLY774C, ILE734C, ILE796C, LEU731A, LEU731C, LEU735C, LEU737C, LEU757A, LEU765A, LEU765C, LEU768A, LEU801C, LEU802C, LEU803C, LYS729A, LYS753A, MET759A, PHE732A, PHE732C, PHE745A, PRO743C, PRO744A, PRO773C, PRO792C, PRO804C, PRO807C, SER741C, SER748A, SER751A, SER769A, SER797A, THR750A, THR772A, THR776C, THR794C, THR806C, TRP767A, VAL749A, VAL760A, VAL771A, VAL789C, VAL791C
• A-D: ALA733A, ALA733D, ALA738A, ALA738D, ARG736A, ARG736D, ASP739A, ASP739D, CYS805A, CYS805D, GLN742A, GLN742D, GLN799A, GLN799D, GLN800A, GLN800D, GLU763A, GLU763D, GLY740A, GLY740D, ILE734A, ILE734D, LEU735A, LEU735D, LEU737A, LEU737D, LEU765D, LEU801A, LEU801D, LEU802A, LEU802D, LEU803A, LEU803D, PHE732A, PHE732D, PRO792A, PRO792D, PRO804A, PRO804D, SER741A, SER741D, THR806A, THR806D
• A-E: ALA747E, ALA795A, ARG730A, ARG736E, ASP739E, ASP762E, ASP782E, ASP798A, CB9.92951-5.86666, CYS787E, CYS805E, GLN742E, GLN786E, GLN799A, GLN800A, GLU763E, GLU793A, GLY728A, GLY740E, GLY764E, ILE796A, LEU731A, LEU737E, LEU801A, LYS729A, LYS729A9, PHE732A, PHE745E, PRO743E, PRO744E, PRO773A, PRO807E, SER741E, SER797A, THR794A, TRP781E
• B-C: ALA733C, ALA747B, ALA761B, ALA761C, ALA766B, ALA766C, ARG736C, ASP762B, ASP762C, ASP798C, GLN742C, GLN799C, GLN800C, GLU756B, GLU763B, GLU763C, GLY746B, GLY758B, GLY764B, GLY764C, ILE734C, LEU731C, LEU765B, LEU765C, LEU801C, LEU802C, LEU803C, MET759B, PHE732B, PHE732C, PHE745B, PHE745C, SER797C, TRP767B, TRP767C, VAL760B, VAL760C
• B-D: ALA747D, ALA795B, ARG730B, ARG736D, ASP739D, ASP762D, ASP782D, ASP798B, GLN742D, GLN786D, GLN799B, GLN800B, GLU763D, GLU793B, GLY728B, GLY740D, GLY764D, ILE796B, LEU731B, LEU737D, LEU801B, LYS729B, LYS784D, PHE732B, PHE745D, PRO743D, PRO744D, PRO773B, SER741D, SER797B, THR794B, TRP781D
• B-E: ALA733B, ALA733E, ALA738B, ALA738E, ARG736B, ARG736E, ASP739B, ASP739E, CYS805B, CYS805E, GLN742B, GLN742E, GLN799B, GLN799E, GLN800B, GLN800E, GLU763B, GLU763E, GLY740B, GLY740E, GLY764B, ILE734B, ILE734E, LEU735B, LEU735E, LEU737B, LEU737E, LEU765B, LEU765E, LEU801B, LEU801E, LEU802B, LEU802E, LEU803B, LEU803E, PHE732B, PHE732E, PRO792B, PRO792E, PRO804B, PRO804E, SER741B, SER741E, THR806B, THR806E
• C-E: ASP762E, ASP798C, GLN742E, GLN799C, GLU763E, ILE796C, SER797C
• D-E: ASP739D, ASP739E