3B6W

crystal structure of the glur2 ligand binding core (s1s2j) t686s mutant in complex with glutamate at 1.7 resolution

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 113
  • Norm. En. per Res.: -2.658
• 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	-9.9288	-49.5504	-72.0967	-131.5759	72	3	0	3361	2	41	30
A-C	-64.14	-48.3335	-187.879	-300.3525	113	11	5	9441	4	43	38
B-D	-56.745	-4.1071	-192.747	-253.5991	108	6	5	8700	2	42	34

Interface residues

• A-B: ALA646B, ALA677A, ALA677B, ALA691A, ARG420A, ARG675A, ARG675B, ARG684A, ARG684B, ARG692A, ARG692B, ASN411A, ASN461B, ASP447A, ASP447B, ASP651B, GLU413A, GLU413B, GLU416A, GLU466B, GLU678A, GLU678B, GLU688A, GLU688B, GLY417A, GLY446A, GLY446B, GLY462B, GLY465B, GLY470A, GLY689A, GLY689B, HIS412A, HIS412B, ILE444A, ILE459B, LEU415A, LEU650B, LYS410A, LYS449A, LYS471A, LYS471B, LYS695A, LYS697B, LYS699B, MET408A, MET408B, MET414A, PHE682A, PHE682B, PRO679A, PRO679B, SER676A, SER676B, SER680A, SER680B, SER696A, THR457B, THR649B, THR685A, THR685B, TRP460B, TYR469A, TYR469B, TYR700A, TYR700B, VAL468B, VAL681A, VAL681B, VAL683A, VAL683B, VAL693A
• A-C: ALA735A, ALA735C, ALA745C, ALA749A, ALA749C, ARG485A, ARG485C, ARG660A, ARG661A, ARG661C, ASN726A, ASN726C, ASN744A, ASN744C, ASN747A, ASN747C, ASN754A, ASN754C, ASN764A, ASP490A, ASP490C, ASP728A, ASP728C, ASP760A, ASP760C, GLN756A, GLN756C, GLU486A, GLU486C, GLU487A, GLU487C, GLU657A, GLU657C, GLU755A, GLU755C, GLY731A, GLY731C, GLY733A, GLY733C, GLY757A, GLY757C, HIS435C, ILE481A, ILE481C, ILE489A, ILE489C, ILE500A, ILE664A, ILE664C, ILE734A, ILE734C, LEU483A, LEU483C, LEU498A, LEU498C, LEU727A, LEU727C, LEU748A, LEU748C, LEU751A, LEU751C, LEU753A, LEU753C, LEU758A, LEU758C, LEU759A, LEU759C, LYS493A, LYS493C, LYS663A, LYS663C, LYS730A, LYS730C, LYS738A, LYS738C, LYS752A, LYS752C, LYS761A, LYS761C, MET496A, MET496C, PHE491A, PHE491C, PHE495A, PHE495C, PHE658A, PHE658C, PHE659A, PHE667A, PHE667C, PRO494A, PRO494C, SER492A, SER492C, SER497A, SER497C, SER654A, SER654C, SER662A, SER662C, SER729A, SER729C, THR480A, THR480C, THR482A, THR482C, TYR732A, VAL484A, VAL484C, VAL488A, VAL488C, VAL750A, VAL750C
• B-D: ALA735B, ALA735D, ALA745B, ALA745D, ALA749B, ALA749D, ARG485B, ARG485D, ARG661B, ARG661D, ASN726B, ASN726D, ASN744B, ASN744D, ASN747B, ASN747D, ASN754B, ASN754D, ASP490B, ASP490D, ASP728B, ASP728D, ASP760B, ASP760D, GLN756B, GLN756D, GLU486B, GLU486D, GLU487B, GLU487D, GLU657B, GLU657D, GLU755B, GLU755D, GLY731B, GLY731D, GLY733B, GLY733D, GLY757B, GLY757D, HIS435B, HIS435D, ILE481B, ILE481D, ILE489B, ILE489D, ILE664B, ILE664D, ILE734B, ILE734D, LEU483B, LEU483D, LEU498B, LEU498D, LEU727B, LEU727D, LEU748B, LEU748D, LEU751B, LEU751D, LEU753B, LEU753D, LEU759B, LEU759D, LYS493B, LYS493D, LYS663B, LYS663D, LYS730B, LYS730D, LYS738B, LYS738D, LYS752B, LYS752D, LYS761D, LYS763B, MET496B, MET496D, PHE491B, PHE491D, PHE495B, PHE495D, PHE658B, PHE658D, PHE667B, PRO494B, PRO494D, SER492B, SER492D, SER497B, SER497D, SER654B, SER654D, SER662B, SER662D, SER729B, SER729D, THR480B, THR480D, THR482B, THR482D, TYR732D, VAL484B, VAL484D, VAL488B, VAL488D, VAL750B, VAL750D