1VRC

complex of enzyme iiamannose and the histidine-containing phosphocarrier protein hpr from escherichia coli nmr, restrained regularized mean structure

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 156
  • Norm. En. per Res.: -3.5943
• 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	-87.8676	22.0701	-494.914	-560.7115	156	24	19	21351	0	34	27
A-C	0.0	-16.5288	-73.4159	-89.9447	53	4	4	4401	0	24	9
A-D	0.0	1.8398	-50.7832	-48.9434	42	3	0	2352	0	5	4
B-C	0.0	1.8393	-48.981	-47.1417	42	7	0	2407	0	5	4
B-D	0.0	-16.5123	-73.1855	-89.6978	53	4	4	4397	0	24	9

Interface residues

• A-B: ALA116A, ALA116B, ALA118A, ALA118B, ALA128A, ALA128B, ALA13A, ALA13B, ALA14A, ALA14B, ALA21A, ALA21B, ALA77A, ALA77B, ALA91A, ALA91B, ARG123A, ARG123B, ARG79A, ARG79B, ASN75A, ASN75B, ASN94A, ASN94B, ASP35A, ASP35B, ASP67A, ASP67B, ASP83A, ASP83B, GLN16A, GLN16B, GLU100A, GLU100B, GLU120A, GLU120B, GLU124A, GLU124B, GLU15A, GLU15B, GLU22A, GLU22B, GLU40A, GLU40B, GLU85A, GLU85B, GLU88A, GLU88B, GLY11A, GLY11B, GLY122A, GLY122B, GLY125A, GLY125B, GLY39A, GLY39B, GLY70A, GLY70B, GLY71A, GLY71B, GLY8A, GLY8B, GLY92A, GLY92B, HIS10A, HIS10B, HIS86A, HIS86B, ILE80A, ILE80B, ILE90A, ILE90B, ILE95A, ILE95B, LEU117A, LEU117B, LEU129A, LEU129B, LEU17A, LEU17B, LEU18A, LEU18B, LEU24A, LEU24B, LEU45A, LEU45B, LEU63A, LEU63B, LEU65A, LEU65B, LEU98A, LEU98B, LYS127A, LYS127B, LYS130A, LYS130B, LYS19A, LYS19B, LYS84A, LYS84B, MET23A, MET23B, MET97A, MET97B, PHE111A, PHE111B, PHE36A, PHE36B, PHE64A, PHE64B, PHE74A, PHE74B, PRO38A, PRO38B, PRO73A, PRO73B, PRO96A, PRO96B, SER72A, SER72B, SER78A, SER78B, THR121A, THR121B, THR20A, THR20B, THR68A, THR68B, THR9A, THR9B, TRP12A, TRP12B, TRP69A, TRP69B, TYR87A, TYR87B, VAL115A, VAL115B, VAL119A, VAL119B, VAL126A, VAL126B, VAL37A, VAL37B, VAL66A, VAL66B, VAL81A, VAL81B, VAL82A, VAL82B, VAL89A, VAL89B, VAL93A, VAL93B, VAL99A, VAL99B
• A-C: ALA104A, ALA219C, ALA21A, ALA220C, ARG105A, ARG123A, ARG217C, ASP106A, ASP107A, GLN221C, GLN251C, GLN28A, GLU100A, GLU120A, GLU124A, GLU225C, GLU22A, GLU27A, GLY122A, GLY125A, GLY228C, GLY26A, HIS215C, ILE95A, LEU102A, LEU117A, LEU247C, LEU24A, LEU250C, LEU253C, LEU25A, LYS127A, LYS224C, LYS227C, LYS245C, LYS249C, MET103A, MET23A, MET97A, PHE222C, PHE248C, PRO109A, PRO218C, PRO96A, SER246C, THR101A, THR121A, THR20A, THR216C, THR252C, VAL126A, VAL223C, VAL99A
• A-D: ALA219D, ALA220D, ALA42A, ALA76A, ALA91A, ARG217D, ARG79A, ASN212D, ASN41A, ASN75A, ASP67A, GLN251D, GLN257D, GLU285D, GLU40A, GLU43A, GLY213D, GLY254D, GLY39A, GLY70A, GLY71A, HIS10A, HIS215D, LEU214D, LEU247D, LEU250D, LEU253D, LEU45A, PHE248D, PHE36A, PHE74A, PRO211D, PRO218D, PRO38A, PRO73A, SER72A, THR216D, THR252D, THR256D, THR68A, TRP69A, VAL37A
• B-C: ALA219C, ALA220C, ALA42B, ALA76B, ALA91B, ARG217C, ARG79B, ASN212C, ASN41B, ASN75B, ASP67B, GLN251C, GLN257C, GLU285C, GLU40B, GLU43B, GLY213C, GLY254C, GLY39B, GLY70B, GLY71B, HIS10B, HIS215C, LEU214C, LEU247C, LEU250C, LEU253C, LEU45B, PHE248C, PHE36B, PHE74B, PRO211C, PRO218C, PRO38B, PRO73B, SER72B, THR216C, THR252C, THR256C, THR68B, TRP69B, VAL37B
• B-D: ALA104B, ALA219D, ALA21B, ALA220D, ARG105B, ARG123B, ARG217D, ASP106B, ASP107B, GLN221D, GLN251D, GLN28B, GLU100B, GLU120B, GLU124B, GLU225D, GLU22B, GLU27B, GLY122B, GLY125B, GLY228D, GLY26B, HIS215D, ILE95B, LEU102B, LEU117B, LEU247D, LEU24B, LEU250D, LEU253D, LEU25B, LYS127B, LYS224D, LYS227D, LYS245D, LYS249D, MET103B, MET23B, MET97B, PHE222D, PHE248D, PRO109B, PRO218D, PRO96B, SER246D, THR101B, THR121B, THR20B, THR216D, THR252D, VAL126B, VAL223D, VAL99B