3Q2O

crystal structure of purk: n5-carboxyaminoimidazole ribonucleotide synthetase

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 170
  • Norm. En. per Res.: -2.6674
• 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	-47.7164	-45.3162	-360.431	-453.4636	170	15	12	16349	6	41	36

Interface residues

• A-B: ALA24A, ALA24B, ALA26A, ALA26B, ALA27A, ALA27B, ALA283A, ALA283B, ALA46A, ALA46B, ALA49A, ALA49B, ARG21A, ARG21B, ARG294A, ARG294B, ARG325A, ARG325B, ARG329A, ARG329B, ASN298A, ASN298B, ASN305A, ASN305B, ASN328A, ASN328B, ASN353B, ASN356A, ASN356B, ASN42A, ASN42B, ASP282A, ASP282B, ASP357A, ASP357B, ASP50A, ASP50B, CYS284A, CYS284B, CYS297A, CYS297B, CYS333A, CYS333B, CYS45A, GLN281A, GLN281B, GLN291A, GLN291B, GLN326A, GLN326B, GLN47A, GLN47B, GLU202A, GLU202B, GLU285A, GLU285B, GLU29A, GLU29B, GLU303A, GLU303B, GLU321A, GLU321B, GLU341A, GLU341B, GLY290A, GLY290B, GLY302A, GLY302B, GLY31A, GLY31B, GLY332A, GLY332B, GLY339A, GLY339B, GLY350A, GLY350B, GLY8A, GLY8B, HIS336A, HIS336B, HIS351A, HIS351B, ILE320A, ILE320B, ILE34A, ILE34B, ILE354A, ILE354B, ILE4A, ILE4B, ILE5A, ILE5B, LEU25A, LEU25B, LEU299A, LEU299B, LEU301A, LEU301B, LEU306A, LEU306B, LEU307A, LEU307B, LEU324A, LEU324B, LEU330A, LEU330B, LEU335A, LEU335B, LEU337A, LEU337B, LEU355A, LEU355B, LEU369B, LEU6A, LEU6B, LYS204A, LYS204B, LYS28A, LYS28B, LYS308A, LYS308B, LYS33A, LYS33B, LYS340A, LYS340B, LYS365A, LYS365B, LYS9A, LYS9B, MET22A, MET22B, MET23B, MET30A, MET30B, MET349A, MET349B, PHE289A, PHE289B, PRO300A, PRO300B, PRO309A, PRO309B, PRO44A, PRO44B, PRO7A, PRO7B, SER287A, SER287B, THR286A, THR286B, THR2A, THR2B, THR304A, THR304B, THR331A, THR331B, TYR32A, TYR32B, TYR334A, TYR334B, TYR338A, TYR338B, VAL323A, VAL323B, VAL327A, VAL327B, VAL352A, VAL352B, VAL48A, VAL48B