2G2I

a src-like inactive conformation in the abl tyrosine kinase domain

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 42
  • Norm. En. per Res.: -2.9807
• 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	-14.7779	6.249	-165.648	-174.1769	96	21	8	8428	0	18	16
A-C	-5.8584	0.0	-85.602	-91.4604	40	1	5	3526	0	10	8
B-D	-21.0786	0.0	-104.112	-125.1906	42	7	4	3920	0	8	4

Interface residues

• A-B: ALA337A, ALA337B, ALA344A, ALA344B, ALA492A, ALA492B, ARG332A, ARG332B, ARG460A, ARG460B, ASN297A, ASN297B, ASN331B, ASN336A, ASN336B, ASN374A, ASN374B, CYS464A, CYS464B, GLN333A, GLN333B, GLN346A, GLN346B, GLN491B, GLN498A, GLN498B, GLU334A, GLU334B, GLU352A, GLU373A, GLU373B, GLU462A, GLU462B, GLU466A, GLU466B, GLU494A, GLU494B, GLU499B, GLY372A, GLY372B, GLY463A, GLY463B, HIS295A, HIS375A, HIS375B, HIS490A, HIS490B, LEU340A, LEU340B, LEU341A, LEU341B, LEU376A, LEU376B, LYS356A, LYS378A, LYS467A, LYS467B, MET318A, MET343A, MET343B, MET496A, MET496B, PHE493A, PHE493B, PHE497A, PHE497B, PRO296A, PRO296B, PRO461A, PRO465A, PRO465B, SER348A, SER348B, SER349A, SER349B, THR319A, THR345A, THR345B, THR495A, THR495B, TYR320A, TYR342A, TYR342B, TYR435A, TYR435B, VAL335A, VAL335B, VAL338A, VAL338B, VAL339A, VAL339B, VAL371A, VAL377A, VAL377B, VAL468A, VAL468B
• A-C: ALA365A, ALA399A, ALA412A, ARG328A, ARG367A, ASN368A, ASN414A, ASP363A, ASP381A, ASP444A, GLU104C, GLU105C, GLU109C, GLU111C, GLU450A, GLY108C, GLY398A, GLY442A, ILE106C, ILE403A, ILE443A, LEU324A, LEU384A, LEU411A, LEU445A, LYS400A, LYS404A, PHE107C, PHE110C, PHE401A, PRO402A, PRO439A, SER410A, SER438A, SER446A, THR406A, TRP405A, TYR413A, TYR449A, VAL448A
• B-D: ALA365B, ALA399B, ALA412B, ARG328B, ARG367B, ASN368B, ASN414B, ASP363B, ASP381B, ASP444B, GLN447B, GLU104D, GLU105D, GLU109D, GLU450B, GLU453B, GLY108D, GLY398B, ILE106D, ILE403B, LEU324B, LEU384B, LEU411B, LEU445B, LEU452B, LYS400B, LYS404B, PHE107D, PHE110D, PHE401B, PRO402B, PRO408B, PRO439B, SER410B, SER438B, SER446B, THR406B, TRP405B, TRP478B, TYR413B, TYR449B, VAL448B