2B1J

crystal structure of unphosphorylated chey bound to the n- terminus of flim

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 49
  • Norm. En. per Res.: -3.9432
• 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-B	-55.831	-30.3221	-93.6338	-179.7868	51	9	3	5130	1	17	17
A-C	-27.1499	-5.3567	-125.865	-158.3716	48	20	10	6189	2	9	7
B-D	-70.1695	-5.5371	-117.509	-193.2156	49	23	9	5893	2	9	7

Interface residues

• A-B: ALA113A, ALA114A, ALA42B, ALA48B, ALA74B, ALA77B, ALA88A, ARG18A, ARG19A, ARG22A, ASN23A, ASN44B, ASN62B, ASP38B, ASP41B, ASP64B, ASP75B, GLN47B, GLU27A, GLU67B, GLY39B, GLY76B, ILE20A, ILE72B, LEU24A, LEU25A, LEU28A, LEU43B, LEU46B, LEU66B, LEU68B, LEU69B, LYS109A, LYS26A, LYS45B, LYS70B, MET17A, MET63B, MET78B, PHE111A, PHE14A, PRO110A, PRO61B, SER15A, SER79B, THR112A, THR115A, THR16A, THR71B, VAL21A, VAL40B
• A-C: ALA103A, ALA13C, ALA88A, ALA90A, ALA97A, ALA98A, ALA99A, ALA9C, ASN16C, ASN94A, ASP12C, ASP3C, GLN100A, GLN8C, GLU10C, GLU118A, GLU89A, GLU93A, GLY102A, GLY105A, GLY2C, ILE11C, ILE123A, ILE5C, ILE95A, ILE96A, LEU14C, LEU15C, LEU6C, LEU84A, LYS109A, LYS119A, LYS122A, LYS126A, LYS91A, LYS92A, MET85A, PHE111A, SER104A, SER4C, SER7C, THR115A, THR87A, TRP58A, TYR106A, VAL107A, VAL108A, VAL83A
• B-D: ALA103B, ALA13D, ALA88B, ALA90B, ALA97B, ALA98B, ALA99B, ALA9D, ASN16D, ASN94B, ASP12D, ASP3D, GLN100B, GLN8D, GLU10D, GLU118B, GLU89B, GLU93B, GLY105B, GLY2D, ILE11D, ILE123B, ILE5D, ILE95B, ILE96B, LEU116B, LEU14D, LEU15D, LEU6D, LEU84B, LYS109B, LYS119B, LYS122B, LYS126B, LYS91B, LYS92B, MET85B, PHE111B, PRO110B, SER104B, SER4D, SER7D, THR112B, THR115B, THR87B, TYR106B, VAL107B, VAL108B, VAL86B