3QEL

crystal structure of amino terminal domains of the nmda receptor subunit glun1 and glun2b in complex with ifenprodil

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 125
  • Norm. En. per Res.: -3.4749
• 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	-37.496	-86.1247	-310.741	-434.3617	125	12	5	12701	4	36	25
B-D	-17.2535	16.6896	-151.609	-152.1729	64	12	9	5717	0	17	16
C-D	-33.7488	-76.4073	-272.249	-382.4051	119	10	6	11258	6	35	24

Interface residues

• A-B: ALA107B, ALA111A, ALA117B, ALA135B, ALA71A, ALA75A, ARG115A, ARG344A, ARG68A, ARG84B, ASN323B, ASN332A, ASN334A, ASN70A, ASN74B, ASP113B, ASP130A, ASP136B, ASP138B, ASP206B, ASP210B, ASP211B, ASP213B, ASP364A, ASP77B, ASP81A, CYS321B, CYS329A, CYS79A, CYS86B, GLN105B, GLN110B, GLN118B, GLN180B, GLN73A, GLU106B, GLU235B, GLU236B, GLU326B, GLU363A, GLU75B, GLU80A, GLY178B, GLY212B, GLY328A, GLY331A, GLY339A, HIS134A, HIS325B, ILE107A, ILE108B, ILE111B, ILE115B, ILE127A, ILE133A, ILE216B, ILE335A, ILE72A, ILE81B, ILE82B, ILE83A, ILE85B, LEU102A, LEU120B, LEU135A, LEU138A, LEU204B, LEU205B, LEU209B, LEU341A, LEU346A, LEU76A, LYS131A, LYS215B, LYS337A, LYS343A, LYS79B, MET134B, MET207B, MET319A, MET347A, MET74A, MET89B, PHE113A, PHE114B, PHE137A, PHE176B, PHE342A, PRO106A, PRO117A, PRO177B, PRO340A, PRO69A, PRO78B, SER116B, SER129A, SER132A, SER136A, SER208B, SER214B, SER320B, SER348A, SER77A, SER80B, SER84A, THR103B, THR105A, THR110A, THR119B, THR174B, THR233B, THR324B, THR333A, THR338A, THR76B, THR83B, TYR109A, TYR114A, TYR175B, TYR179B, TYR231B, TYR322B, VAL330A, VAL345A, VAL78A
• B-D: ALA304B, ALA304D, ARG328B, ARG328D, ARG337B, ARG92B, ASN333B, ASN333D, GLN331B, GLN331D, GLN95B, GLN95D, GLU310B, GLU310D, GLU316B, GLU316D, GLU326B, GLY36B, GLY36D, HIS311B, HIS311D, ILE314B, ILE314D, ILE329B, ILE329D, ILE35B, ILE35D, ILE94D, LEU120B, LEU120D, LEU308B, LEU308D, LYS318B, LYS327B, LYS327D, LYS93B, LYS93D, MET307B, MET307D, MET334B, MET334D, PHE313B, PHE313D, PRO315B, PRO315D, PRO317B, PRO317D, PRO32B, PRO33B, PRO33D, SER140B, SER312B, SER312D, SER332B, SER332D, SER34B, SER34D, SER63B, TYR330B, TYR330D, TYR338D, VAL64B, VAL64D, VAL65B
• C-D: ALA107D, ALA111C, ALA117D, ALA135D, ALA71C, ALA75C, ARG115C, ARG344C, ARG84D, ASN323D, ASN332C, ASN334C, ASN70C, ASN74D, ASP113D, ASP130C, ASP136D, ASP138D, ASP206D, ASP210D, ASP211D, ASP213D, ASP364C, ASP77D, ASP81C, ASP87D, CYS321D, CYS329C, CYS79C, CYS86D, GLN105D, GLN110D, GLN118D, GLN180D, GLN73C, GLU106D, GLU235D, GLU236D, GLU363C, GLU75D, GLU80C, GLY178D, GLY212D, GLY328C, GLY331C, GLY339C, HIS134C, ILE107C, ILE108D, ILE111D, ILE115D, ILE133C, ILE216D, ILE335C, ILE72C, ILE81D, ILE82D, ILE83C, LEU102C, LEU135C, LEU138C, LEU204D, LEU205D, LEU209D, LEU341C, LEU346C, LEU76C, LYS131C, LYS215D, LYS337C, LYS343C, LYS79D, MET134D, MET207D, MET319C, MET347C, MET74C, MET89D, PHE113C, PHE114D, PHE137C, PHE176D, PHE342C, PRO106C, PRO117C, PRO177D, PRO340C, PRO69C, PRO78D, SER129C, SER132C, SER136C, SER208D, SER214D, SER320D, SER348C, SER77C, SER80D, SER84C, THR103C, THR103D, THR105C, THR110C, THR119D, THR174D, THR233D, THR333C, THR338C, THR76D, THR83D, TYR109C, TYR114C, TYR175D, TYR179D, TYR322D, VAL330C, VAL345C, VAL42D, VAL78C