2PYY

crystal structure of the glur0 ligand-binding core from nostoc punctiforme in complex with (l)-glutamate

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 103
  • Norm. En. per Res.: -4.2107
• 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	-42.1375	4.2937	-125.152	-162.9958	79	3	2	6034	2	35	32
A-C	0.0	0.0	-0.0003	-0.0003	2	0	0	1	0	0	0
B-C	-79.0334	-132.902	-221.77	-433.7054	103	12	4	9014	11	28	30

Interface residues

• A-B: ALA114A, ALA114B, ALA117A, ALA117B, ALA122A, ALA122B, ALA141B, ALA144A, ALA144B, ALA150A, ALA150B, ARG126A, ARG126B, ASN78A, ASP151A, ASP151B, GLN77A, GLN77B, GLU127A, GLU127B, GLU134A, GLU134B, GLU140A, GLU140B, GLU52A, GLU52B, GLY110A, GLY110B, GLY118A, GLY118B, HIS128A, HIS128B, HIS129A, HIS129B, ILE130A, ILE130B, LEU125A, LEU125B, LEU133A, LEU133B, LYS111A, LYS111B, LYS137A, LYS137B, LYS148A, LYS148B, LYS149A, LYS149B, LYS58A, LYS58B, PRO109A, PRO109B, PRO136A, PRO136B, PRO51A, PRO51B, SER119A, SER119B, SER131A, SER131B, SER48A, SER48B, SER49A, SER49B, THR115A, THR115B, THR116A, THR116B, THR123A, THR147B, TYR47A, VAL112A, VAL112B, VAL113A, VAL113B, VAL132A, VAL132B, VAL135A, VAL135B
• A-C: GLN200C, LYS58A
• B-C: ALA201B, ALA201C, ALA73B, ALA73C, ALA87B, ALA87C, ARG180B, ARG180C, ARG195B, ARG195C, ARG75B, ARG75C, ASN190B, ASN190C, ASN191B, ASN191C, ASN199B, ASN199C, ASN204B, ASN204C, ASN208B, ASN208C, ASN78B, ASN78C, ASP80B, ASP80C, GLN200B, GLN200C, GLN212B, GLN212C, GLN37B, GLN77B, GLN77C, GLU127B, GLU181B, GLU181C, GLU182B, GLU182C, GLU207B, GLU207C, GLU226B, GLU74B, GLU74C, GLU76B, GLU76C, GLY185B, GLY185C, GLY209C, HIS128B, ILE178C, ILE198B, ILE198C, ILE71B, ILE71C, ILE85B, ILE85C, LEU179C, LEU188B, LEU188C, LEU202B, LEU202C, LEU203B, LEU203C, LEU205B, LEU205C, LEU225B, LEU83B, LEU83C, LYS196B, LYS196C, LYS206B, LYS206C, PHE79B, PHE79C, PHE81B, PHE81C, PRO189B, PRO189C, PRO197B, PRO197C, PRO84B, PRO84C, SER183B, SER183C, SER192B, SER192C, SER224B, SER70B, SER70C, SER82B, SER82C, SER88C, THR120B, THR123B, THR72B, THR72C, TYR124B, TYR124C, TYR184B, TYR184C, TYR211B, TYR211C, TYR215C