3GL3

crystal structure of a putative thiol:disulfide interchange protein dsbe from chlorobium tepidum

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 66
  • Norm. En. per Res.: -2.098
• 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	0.0	-9.0814	-9.656	-18.7374	14	1	0	445	1	8	3
A-D	0.0	-11.4196	-127.05	-138.4696	66	4	1	5706	1	17	16
B-C	0.0	-5.0473	-125.678	-130.7253	67	3	1	5702	0	18	17
B-D	0.0	-8.1666	-10.7238	-18.8904	13	1	0	459	1	7	3
C-D	-14.1479	0.0	-77.615	-91.7629	48	2	3	3598	0	8	9

Interface residues

• A-C: ASP30A, GLN89C, GLY128A, GLY131A, GLY45C, LEU29A, LYS130A, LYS43C, LYS84C, SER28A, THR114C, THR44C, VAL129A, VAL149A
• A-D: ALA102A, ALA63A, ALA63D, ALA97A, ALA97D, ARG125A, ARG125D, ARG152A, ASP101A, ASP101D, ASP118A, ASP118D, ASP155A, ASP96A, ASP96D, CYS66A, CYS66D, CYS69A, GLN122A, GLN122D, GLN71A, GLY100A, GLY121A, GLY121D, GLY128A, GLY128D, GLY131A, GLY131D, GLY150A, GLY67A, HIS148A, LEU126D, LEU95A, LEU95D, LYS104A, LYS104D, LYS120A, LYS120D, LYS130A, LYS130D, LYS98A, LYS98D, PHE105A, PHE151A, PHE61D, PRO119A, PRO119D, PRO124A, PRO124D, PRO133A, PRO133D, PRO68A, SER64A, SER64D, THR123D, THR134A, THR134D, THR99D, TRP62D, TRP65A, TRP65D, TYR127D, VAL129A, VAL129D, VAL149A, VAL149D
• B-C: ALA102B, ALA63B, ALA63C, ALA97B, ALA97C, ARG125B, ARG125C, ARG152B, ASP101B, ASP101C, ASP118B, ASP118C, ASP155B, ASP96B, ASP96C, CYS66B, CYS66C, CYS69B, GLN122B, GLN122C, GLN71B, GLY100B, GLY121B, GLY121C, GLY128B, GLY128C, GLY131B, GLY131C, GLY150B, GLY67B, GLY67C, HIS148B, LEU126C, LEU95B, LEU95C, LYS104B, LYS104C, LYS120B, LYS120C, LYS130B, LYS130C, LYS98B, LYS98C, PHE105B, PHE151B, PHE61C, PRO119B, PRO119C, PRO124B, PRO124C, PRO133B, PRO133C, PRO68B, SER64B, THR123B, THR123C, THR134B, THR134C, THR99C, TRP62C, TRP65B, TRP65C, TYR127C, VAL129B, VAL129C, VAL149B, VAL149C
• B-D: ASP30B, ASP33B, GLY128B, GLY131B, GLY45D, LEU29B, LYS130B, LYS43D, LYS84D, THR114D, THR44D, VAL129B, VAL149B
• C-D: ALA107C, ALA107D, ALA116D, ALA39C, ALA39D, ALA97C, ALA97D, ASP118C, ASP118D, ASP96C, ASP96D, GLN122C, GLN122D, GLY100C, GLY100D, GLY121C, GLY121D, GLY42C, GLY42D, GLY45C, GLY45D, LEU106D, LEU40C, LEU40D, LYS104C, LYS104D, LYS120C, LYS120D, LYS43C, LYS43D, LYS48C, LYS48D, LYS98C, LYS98D, PHE117C, PHE117D, PRO119C, PRO119D, PRO41C, PRO41D, THR44C, THR44D, THR99C, THR99D, VAL46C, VAL46D, VAL47C, VAL47D