3FHM

crystal structure of the cbs-domain containing protein atu1752 from agrobacterium tumefaciens

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 43
  • Norm. En. per Res.: -2.6097
• Hub Node: A(3)

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	-8.3851	-35.9642	-67.8687	-112.218	43	1	2	2747	1	12	9
A-C	0.0	0.0	-0.6006	-0.6006	8	0	0	124	0	7	1
A-D	-26.3222	24.4116	-247.532	-249.4426	115	6	20	12358	10	36	45
B-C	-24.4992	24.9355	-238.84	-238.4037	115	15	19	12198	9	36	44
B-D	0.0	-9.8327	-8.3104	-18.1431	16	0	0	589	1	3	1
C-D	0.0	0.0	-22.569	-22.569	16	0	0	1038	0	0	1

Interface residues

• A-B: ALA28A, ALA29A, ALA34A, ALA45A, ARG102B, ARG113A, ARG84B, ASN81B, ASP15A, ASP92B, CYS85B, GLN86B, GLN93B, GLU27A, GLU96B, GLY100B, GLY101B, GLY26A, GLY30A, HIS33A, HIS35A, ILE25A, ILE37A, ILE97B, LEU32A, LEU50B, LYS36A, LYS60B, LYS80B, MET95B, MET98B, PHE103B, SER24A, THR18A, THR31A, THR79B, THR99B, VAL106B, VAL16A, VAL17A, VAL23A, VAL82B, VAL83B
• A-C: ASP22A, GLU27A, GLY20A, HIS33A, ILE128C, LYS36C, SER24A, VAL23A
• A-D: ALA126A, ALA126D, ALA28A, ALA28D, ALA29A, ALA29D, ALA34A, ALA34D, ALA39A, ALA39D, ALA61A, ALA61D, ALA63A, ALA63D, ALA67A, ALA67D, ALA68A, ALA68D, ARG102A, ARG102D, ARG104A, ARG104D, ARG127A, ARG127D, ARG56A, ARG56D, ASP122A, ASP122D, ASP57A, ASP57D, ASP92A, ASP92D, GLN65A, GLN65D, GLN71A, GLN71D, GLN93A, GLN93D, GLU27A, GLU27D, GLU55A, GLU55D, GLU96A, GLU96D, GLY100A, GLY100D, GLY121A, GLY121D, GLY129A, GLY26A, GLY26D, GLY30A, GLY30D, GLY38A, GLY38D, GLY64A, GLY64D, GLY66A, GLY66D, HIS105A, HIS105D, HIS33A, HIS33D, HIS35A, HIS35D, ILE120A, ILE120D, ILE128A, ILE128D, ILE25A, ILE25D, ILE37A, ILE37D, ILE97A, ILE97D, LEU32A, LEU32D, LEU58A, LEU58D, LEU70A, LEU70D, LEU94A, LEU94D, LYS125A, LYS125D, LYS36A, LYS36D, LYS60A, LYS60D, MET95A, MET95D, MET98A, MET98D, PHE53A, PHE53D, SER119A, SER119D, SER69A, SER69D, THR31A, THR31D, THR54A, THR54D, THR91A, THR91D, THR99A, THR99D, VAL123A, VAL123D, VAL124A, VAL124D, VAL59A, VAL59D, VAL62A, VAL62D
• B-C: ALA126B, ALA126C, ALA28B, ALA28C, ALA29B, ALA29C, ALA34B, ALA34C, ALA39B, ALA39C, ALA61B, ALA61C, ALA63B, ALA63C, ALA67B, ALA67C, ALA68B, ALA68C, ARG102B, ARG102C, ARG104B, ARG104C, ARG11C, ARG127B, ARG127C, ARG56B, ARG56C, ASP122B, ASP122C, ASP57B, ASP57C, ASP92B, ASP92C, GLN65B, GLN65C, GLN71B, GLN71C, GLN93B, GLN93C, GLU27B, GLU27C, GLU55B, GLU55C, GLU96B, GLU96C, GLY100B, GLY100C, GLY121B, GLY121C, GLY26B, GLY26C, GLY30B, GLY30C, GLY38B, GLY38C, GLY64B, GLY64C, GLY66B, GLY66C, HIS105B, HIS105C, HIS33B, HIS33C, HIS35B, HIS35C, ILE120B, ILE120C, ILE128B, ILE128C, ILE25B, ILE25C, ILE37B, ILE37C, ILE97B, ILE97C, LEU32B, LEU32C, LEU58B, LEU58C, LEU70B, LEU70C, LEU94B, LEU94C, LYS125B, LYS125C, LYS36B, LYS36C, LYS60B, LYS60C, MET95B, MET95C, MET98B, MET98C, PHE53B, PHE53C, SER119B, SER119C, SER69B, SER69C, THR31B, THR31C, THR54B, THR54C, THR91B, THR91C, THR99B, THR99C, VAL123B, VAL123C, VAL124B, VAL124C, VAL59B, VAL59C, VAL62B, VAL62C
• B-D: ALA61D, ALA63D, ARG102B, ASP92B, GLN65D, GLN93B, GLU96B, GLY100B, GLY101B, GLY64D, GLY66D, ILE97B, LYS60D, MET95B, THR99B, VAL62D
• C-D: ALA126C, ALA61D, ALA63D, ALA67D, ALA68D, ARG11C, ARG127C, GLN65D, GLN72D, GLY64D, GLY66D, ILE128C, LYS125C, LYS60D, SER69D, VAL62D