3CEM

human glycogen phosphorylase (tense state) in complex with the allosteric inhibitor ave9423

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 216
  • Norm. En. per Res.: -2.8182
• 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	-78.6136	-2.6933	-527.416	-608.7229	216	25	17	24053	6	78	115

Interface residues

• A-B: ALA179A, ALA179B, ALA246A, ALA246B, ALA248A, ALA248B, ALA265A, ALA265B, ALA272B, ALA46A, ALA46B, ALA610A, ALA610B, ARG171B, ARG184A, ARG184B, ARG193A, ARG193B, ARG242A, ARG242B, ARG247A, ARG247B, ARG269A, ARG269B, ARG277A, ARG277B, ARG292A, ARG292B, ARG33A, ARG33B, ARG43A, ARG43B, ARG49A, ARG49B, ARG60A, ARG60B, ARG66A, ARG66B, ARG69A, ARG69B, ASN167A, ASN167B, ASN250A, ASN250B, ASN270A, ASN270B, ASN274A, ASN274B, ASN282A, ASN282B, ASN44A, ASN44B, ASP180A, ASP180B, ASP181A, ASP181B, ASP227A, ASP227B, ASP251A, ASP251B, ASP261A, ASP261B, ASP268A, ASP268B, ASP42A, ASP42B, ASP50A, ASP50B, ASP61A, ASP61B, GLN175B, GLN264A, GLN264B, GLN295A, GLN295B, GLN71A, GLN71B, GLN72A, GLN72B, GLU162A, GLU162B, GLU177A, GLU177B, GLU178A, GLU178B, GLU190A, GLU190B, GLU195A, GLU195B, GLU273A, GLU273B, GLU287A, GLU287B, GLY164A, GLY164B, GLY186A, GLY186B, GLY612A, GLY612B, GLY65A, GLY65B, HIS34A, HIS34B, HIS36A, HIS36B, HIS57A, HIS57B, HIS62A, HIS62B, ILE165A, ILE165B, ILE263A, ILE263B, ILE275A, ILE275B, ILE68A, ILE68B, LEU183A, LEU183B, LEU222A, LEU222B, LEU224A, LEU224B, LEU267A, LEU267B, LEU271A, LEU271B, LEU279A, LEU279B, LEU291A, LEU291B, LEU35A, LEU35B, LEU39A, LEU39B, LEU63A, LEU63B, LYS169A, LYS169B, LYS191A, LYS191B, LYS289A, LYS289B, LYS41A, LYS41B, LYS608B, LYS617A, LYS617B, MET197A, MET197B, PHE166A, PHE166B, PHE196A, PHE196B, PHE252A, PHE252B, PHE37A, PHE37B, PHE53A, PHE53B, PRO194A, PRO194B, PRO225A, PRO225B, PRO229A, PRO229B, PRO249A, PRO249B, PRO281A, PRO281B, PRO611A, PRO611B, SER192A, SER192B, SER245A, SER276A, SER276B, THR38A, THR38B, THR47A, THR47B, THR48A, THR58A, THR58B, TRP182A, TRP182B, TRP67A, TRP67B, TYR161A, TYR161B, TYR163A, TYR163B, TYR185A, TYR185B, TYR226A, TYR226B, TYR262A, TYR262B, TYR280A, TYR280B, TYR75A, TYR75B, VAL176A, VAL176B, VAL238A, VAL238B, VAL266A, VAL266B, VAL278A, VAL278B, VAL40A, VAL40B, VAL45A, VAL45B, VAL64A, VAL64B