3R31

crystal structure of betaine aldehyde dehydrogenase from agrobacterium tumefaciens

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 229
  • Norm. En. per Res.: -3.83
• 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	-224.2914	-54.4002	-598.388	-877.0795	229	28	33	24874	7	50	74

Interface residues

• A-B: ALA144A, ALA144B, ALA230A, ALA230B, ALA245A, ALA245B, ALA246A, ALA246B, ALA247A, ALA247B, ALA248A, ALA248B, ALA249A, ALA249B, ALA421A, ALA421B, ALA432A, ALA432B, ALA441A, ALA441B, ALA472A, ALA472B, ALA473A, ALA473B, ALA474A, ALA474B, ALA70A, ALA70B, ARG148A, ARG148B, ARG242A, ARG242B, ARG434A, ARG434B, ARG468A, ARG468B, ASN225A, ASN225B, ASN414A, ASN414B, ASN447A, ASN447B, ASN450A, ASN450B, ASN470A, ASN470B, ASP135A, ASP135B, ASP142A, ASP142B, ASP272B, ASP437A, ASP437B, CYS452A, CYS452B, GLN463A, GLN463B, GLN65A, GLU258B, GLU417A, GLU417B, GLU440A, GLU440B, GLU455A, GLU455B, GLU469A, GLU469B, GLU476A, GLU476B, GLU480A, GLU480B, GLY241A, GLY241B, GLY250A, GLY250B, GLY419A, GLY419B, GLY422A, GLY422B, GLY423A, GLY423B, GLY438A, GLY438B, GLY442A, GLY442B, GLY459A, GLY459B, GLY460A, GLY460B, GLY465A, GLY465B, GLY467A, GLY467B, GLY489A, GLY489B, HIS251A, HIS251B, HIS254A, HIS254B, HIS433A, HIS433B, HIS477A, HIS477B, ILE137A, ILE137B, ILE446A, ILE446B, ILE456A, ILE456B, LEU139A, LEU139B, LEU151A, LEU151B, LEU234A, LEU234B, LEU252A, LEU252B, LEU259A, LEU259B, LEU410A, LEU410B, LEU420A, LEU420B, LEU429A, LEU429B, LEU439A, LEU439B, LEU444A, LEU444B, LEU451A, LEU451B, LEU481A, LEU481B, LYS147A, LYS147B, LYS243A, LYS243B, LYS253A, LYS253B, LYS462A, LYS462B, LYS482A, LYS482B, LYS62A, LYS66A, LYS66B, MET257A, MET257B, PHE123A, PHE123B, PHE143A, PHE143B, PHE418A, PHE418B, PHE425A, PHE425B, PHE458A, PHE458B, PHE466A, PHE466B, PRO138A, PRO138B, PRO150B, PRO227A, PRO227B, PRO239A, PRO239B, PRO453A, PRO453B, PRO457A, PRO457B, SER237A, SER237B, SER275A, SER275B, SER461A, SER461B, SER464A, SER464B, SER471A, SER471B, SER479A, SER479B, SER487A, SER487B, THR146A, THR146B, THR240A, THR240B, THR443A, THR443B, THR448A, THR448B, THR483A, THR483B, THR488A, THR488B, TRP445A, TRP445B, TYR136A, TYR136B, TYR145A, TYR145B, TYR449A, TYR449B, TYR485A, TYR485B, VAL149A, VAL149B, VAL229A, VAL229B, VAL238A, VAL238B, VAL244A, VAL244B, VAL255A, VAL255B, VAL424A, VAL424B, VAL435A, VAL435B, VAL436A, VAL436B, VAL454A, VAL454B, VAL484A, VAL484B, VAL486A, VAL486B