2HZ4

abl kinase domain unligated and in complex with tetrahydrostaurosporine

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 73
  • Norm. En. per Res.: -2.0492
• 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	-6.3483	-12.8098	-130.431	-149.5892	73	1	0	4775	0	20	16
A-C	0.0	5.3788	-26.7165	-21.3377	57	1	1	1681	0	13	9

Interface residues

• A-B: ALA395A, ALA397A, ALA399A, ARG362A, ARG386A, ASN331B, ASN336B, ASN358A, ASN374B, ASN414A, ASP276A, ASP391A, GLN300B, GLN333B, GLN346B, GLU275A, GLU279A, GLU281A, GLU282A, GLU316B, GLU334B, GLU373B, GLY303B, GLY321B, GLY372B, GLY390A, HIS375B, HIS396A, ILE314B, ILE360A, LEU266B, LEU284A, LEU302B, LEU340B, LEU341B, LEU376B, LEU387A, LYS263B, LYS274A, LYS285A, LYS294B, LYS378B, LYS415A, MET237B, MET278A, MET318B, MET343B, MET388A, PHE317B, PHE359A, PHE497B, PRO296B, SER265B, SER385A, THR267B, THR277A, THR319B, THR345B, THR389A, THR392A, THR394A, TRP261B, TYR264B, TYR320B, TYR326B, TYR342B, TYR393A, TYR413A, VAL268B, VAL280A, VAL335B, VAL338B, VAL339B
• A-C: ALA337A, ASN336A, ASN336C, ASN374A, ASN374C, GLN300A, GLN300C, GLN333A, GLN333C, GLN498A, GLN498C, GLU334A, GLU334C, GLU373A, GLU373C, GLU494A, GLU494C, GLU499C, HIS375A, HIS375C, HIS490A, LEU266A, LEU302A, LEU302C, LEU341C, LEU376A, LEU376C, LYS234A, LYS262A, LYS262C, LYS263A, LYS263C, LYS294A, LYS294C, PHE317A, PHE497A, PHE497C, PRO296A, PRO296C, SER265A, SER500A, SER500C, THR267A, THR319A, THR345A, TRP235A, TRP235C, TRP261A, TRP261C, TYR264A, TYR264C, TYR342A, TYR342C, VAL338A, VAL338C, VAL339A, VAL339C