2ELC

crystal structure of ttha1842 from thermus thermophilus hb8

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 75
  • Norm. En. per Res.: -2.9196
• 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-C	-2.8071	9.2393	-68.1633	-61.731	52	1	0	3039	0	19	24
A-D	-8.5585	0.0	-189.117	-197.6755	72	3	22	9277	0	6	13
B-C	0.0	-19.1305	-199.841	-218.9715	75	1	21	9346	0	8	15
B-D	-7.0243	25.1359	-97.038	-78.9264	53	3	1	3794	0	17	21
C-D	-25.8423	12.0958	-136.356	-150.1024	77	14	0	5822	1	24	25

Interface residues

• A-C: ALA156C, ALA161A, ALA165A, ALA24A, ALA24C, ALA27A, ALA27C, ALA35A, ALA36A, ALA58C, ALA62C, ALA63C, ARG151C, ARG158A, ARG158C, ARG164A, ARG23A, ARG23C, ARG34A, ARG60C, ARG64C, GLU134C, GLU166A, GLU29A, GLU29C, GLU61C, GLY28A, GLY28C, HIS154C, HIS159A, HIS159C, LEU167A, LEU25C, MET157C, MET26A, MET26C, PHE153C, PRO132C, PRO133C, PRO155C, PRO162A, PRO32A, PRO65C, SER31A, SER31C, TYR19C, VAL152C, VAL160A, VAL163A, VAL30A, VAL30C, VAL33A
• A-D: ALA165A, ALA165D, ALA35A, ALA35D, ALA36A, ALA36D, ALA41A, ALA41D, ALA7A, ALA7D, ARG164A, ARG164D, ARG170A, ARG170D, ARG34A, ARG34D, ARG45A, ARG45D, GLU11A, GLU11D, GLU166A, GLU166D, GLY10A, GLY10D, GLY168A, GLY168D, GLY37A, GLY37D, GLY46A, GLY46D, ILE8A, ILE8D, LEU167A, LEU167D, LEU38A, LEU38D, LEU39A, LEU39D, LEU42A, LEU42D, LEU44A, LEU44D, LEU9A, LEU9D, LYS5A, LYS5D, LYS6A, LYS6D, MET1A, PRO162A, PRO162D, PRO32A, PRO32D, SER31A, SER31D, SER43A, SER43D, THR171A, THR171D, VAL160A, VAL163A, VAL163D, VAL169A, VAL169D, VAL30A, VAL30D, VAL33A, VAL33D, VAL40A, VAL40D, VAL4A, VAL4D
• B-C: ALA161C, ALA165B, ALA165C, ALA35B, ALA35C, ALA36B, ALA36C, ALA41B, ALA41C, ALA7B, ALA7C, ARG164B, ARG164C, ARG170B, ARG170C, ARG34B, ARG34C, ARG45B, ARG45C, GLU11B, GLU11C, GLU166B, GLU166C, GLY10B, GLY10C, GLY168B, GLY168C, GLY37B, GLY37C, GLY46B, GLY83C, HIS159C, ILE8B, ILE8C, LEU167B, LEU167C, LEU38B, LEU38C, LEU39B, LEU39C, LEU42B, LEU42C, LEU44B, LEU44C, LEU9B, LEU9C, LYS5B, LYS5C, LYS6B, LYS6C, MET1B, MET1C, PRO162B, PRO162C, PRO32B, PRO32C, SER31B, SER31C, SER43B, SER43C, THR171B, THR171C, VAL160C, VAL163B, VAL163C, VAL169B, VAL169C, VAL30B, VAL30C, VAL33B, VAL33C, VAL40B, VAL40C, VAL4B, VAL4C
• B-D: ALA156D, ALA161B, ALA165B, ALA24B, ALA24D, ALA27B, ALA27D, ALA35B, ALA36B, ALA58D, ALA62D, ALA63D, ARG158B, ARG158D, ARG164B, ARG23B, ARG23D, ARG34B, ARG60D, ARG64D, GLU134D, GLU166B, GLU20D, GLU29B, GLU29D, GLU61D, GLY28B, GLY28D, HIS154D, HIS159B, HIS159D, LEU167B, LEU25D, MET157B, MET157D, MET26B, MET26D, PHE153D, PRO133D, PRO155B, PRO155D, PRO162B, PRO32B, PRO65D, SER31B, SER31D, TYR19D, VAL160B, VAL160D, VAL163B, VAL30B, VAL30D, VAL33B
• C-D: ALA111C, ALA112C, ALA112D, ALA124C, ALA156C, ALA156D, ALA161C, ALA161D, ALA165C, ALA165D, ALA24C, ALA24D, ALA27C, ALA27D, ALA35C, ALA35D, ALA36C, ALA36D, ARG110C, ARG110D, ARG115C, ARG115D, ARG151C, ARG151D, ARG158C, ARG158D, ARG164C, ARG164D, ARG34C, ARG34D, ASP120C, ASP120D, GLU123C, GLU123D, GLU130C, GLU130D, GLU166C, GLU166D, GLU261C, GLU29C, GLU29D, GLY168C, GLY168D, GLY28C, GLY28D, HIS159C, HIS159D, LEU121C, LEU167C, LEU167D, LEU25C, LEU25D, MET157C, MET157D, MET26C, MET26D, PRO155C, PRO155D, PRO162C, PRO162D, PRO260C, PRO32C, PRO32D, SER113C, SER113D, SER114C, SER31C, SER31D, VAL152C, VAL160C, VAL160D, VAL163C, VAL163D, VAL30C, VAL30D, VAL33C, VAL33D