2VP2

structural studies of nucleoside analog and feedback inhibitor binding to drosophila melanogaster multisubstrate deoxyribonucleoside kinase

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 123
  • Norm. En. per Res.: -3.6485
• Hub Node: A(1)

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	-22.879	-35.3386	-390.544	-448.7616	123	8	6	15815	3	26	18

Interface residues

• A-B: ALA15A, ALA15B, ALA77A, ALA77B, ALA94A, ALA94B, ARG119A, ASN130A, ASN130B, ASN59A, ASN59B, ASN61A, ASN61B, ASN64A, ASN64B, ASP72A, GLN126A, GLN126B, GLN81A, GLN81B, GLN90A, GLN90B, GLU125A, GLU125B, GLU133A, GLU133B, GLU134A, GLU134B, GLU140B, GLU141A, GLU141B, GLU16A, GLU16B, GLY122A, GLY122B, GLY127A, GLY127B, GLY62A, GLY62B, HIS144A, HIS144B, HIS92A, HIS92B, ILE107A, ILE107B, ILE139A, ILE139B, ILE143A, ILE143B, LEU124A, LEU124B, LEU132A, LEU132B, LEU65A, LEU65B, LEU68A, LEU68B, LEU86A, LEU86B, LEU89A, LEU89B, LYS137A, LYS137B, LYS13A, LYS13B, LYS56B, LYS74A, LYS74B, LYS75A, LYS75B, MET128A, MET128B, MET78A, MET78B, MET88A, PHE138A, PHE138B, PHE80A, PHE80B, PRO73A, PRO73B, PRO79A, PRO79B, PRO95A, PRO95B, SER123A, SER123B, SER142A, SER142B, SER82A, SER82B, SER91A, SER91B, THR12A, THR12B, THR131A, THR131B, THR18A, THR18B, THR85A, THR85B, THR87A, THR87B, THR93A, THR93B, TRP135A, TRP135B, TRP76A, TRP76B, TYR129A, TYR129B, TYR136A, TYR136B, TYR14A, TYR14B, TYR83A, TYR83B, VAL60A, VAL60B, VAL63A, VAL63B, VAL84A, VAL84B