2ZAD

crystal structure of muconate cycloisomerase from thermotoga maritima msb8

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 75
  • Norm. En. per Res.: -3.3309
• 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	-78.654	-13.0904	-337.242	-428.9864	134	17	2	12475	7	36	45
B-C	-35.2905	-59.2967	-155.234	-249.8211	75	4	0	6467	4	73	66
C-D	-68.0467	-8.3831	-347.411	-423.8408	132	13	2	12565	6	36	45

Interface residues

• A-B: ALA258A, ALA274A, ALA274B, ALA276A, ALA276B, ALA281A, ALA281B, ALA83A, ALA83B, ARG126A, ARG126B, ARG252A, ARG252B, ARG80A, ARG80B, ARG84A, ARG84B, ASN81A, ASN81B, ASP127A, ASP127B, ASP249A, ASP249B, ASP273A, ASP273B, ASP344A, ASP344B, ASP78A, ASP78B, ASP90A, ASP90B, CYS119A, CYS119B, GLN117A, GLN117B, GLN345A, GLN345B, GLU113A, GLU113B, GLU128A, GLU128B, GLU256A, GLU256B, GLU257A, GLU257B, GLU279A, GLU279B, GLU282A, GLU282B, GLU87A, GLU87B, GLY115A, GLY115B, GLY123A, GLY123B, GLY124A, GLY124B, GLY285A, GLY285B, GLY309A, GLY309B, GLY311A, GLY311B, ILE271A, ILE271B, ILE277A, ILE277B, ILE280A, ILE280B, ILE85A, ILE85B, ILE88A, ILE88B, LEU107A, LEU107B, LEU110A, LEU110B, LEU114A, LEU114B, LEU121A, LEU121B, LEU122A, LEU122B, LEU253A, LEU253B, LEU275A, LEU275B, LEU286A, LEU286B, LEU308A, LEU308B, LYS125A, LYS125B, LYS228A, LYS247A, LYS247B, LYS255A, LYS255B, LYS343A, LYS343B, PHE248A, PHE248B, PHE86A, PHE86B, SER111A, SER111B, SER272A, SER272B, SER283A, SER283B, SER284A, SER284B, THR116A, THR116B, THR246A, THR246B, THR310A, THR310B, TYR120A, TYR120B, TYR82A, TYR82B, VAL118A, VAL118B, VAL250A, VAL250B, VAL254A, VAL254B, VAL278A, VAL278B, VAL342A, VAL342B, VAL79A, VAL79B
• B-C: ARG156B, ARG156C, ARG181B, ARG181C, ARG330B, ARG330C, ARG339B, ARG339C, ARG341B, ARG341C, ASP336B, ASP336C, ASP344B, ASP344C, GLN335B, GLN335C, GLN345B, GLN345C, GLU128B, GLU128C, GLU130B, GLU130C, GLU152B, GLU152C, GLU153B, GLU153C, GLU17B, GLU17C, GLU326B, GLU326C, GLU327B, GLU327C, GLY154B, GLY154C, GLY182B, GLY182C, GLY331B, GLY331C, GLY337B, GLY337C, ILE150B, ILE150C, ILE334B, ILE334C, LYS145B, LYS145C, LYS148B, LYS148C, LYS149B, LYS149C, LYS178B, LYS178C, LYS325B, LYS325C, LYS332B, LYS332C, LYS343B, LYS343C, PHE151B, PHE151C, PHE155B, PHE155C, PHE329B, PHE329C, PHE333B, PHE333C, PRO338B, PRO338C, THR180B, THR180C, VAL157B, VAL179B, VAL179C, VAL328B, VAL328C
• C-D: ALA274C, ALA274D, ALA276C, ALA276D, ALA281C, ALA281D, ALA83C, ALA83D, ARG126C, ARG126D, ARG252C, ARG252D, ARG80C, ARG80D, ARG84C, ARG84D, ASN81C, ASN81D, ASP127C, ASP127D, ASP249C, ASP249D, ASP273C, ASP273D, ASP344C, ASP344D, ASP78C, ASP78D, ASP90C, ASP90D, CYS119C, CYS119D, GLN117C, GLN117D, GLN345C, GLN345D, GLU113C, GLU113D, GLU128C, GLU128D, GLU256C, GLU256D, GLU257C, GLU257D, GLU279C, GLU279D, GLU282C, GLU282D, GLU87C, GLU87D, GLY115C, GLY115D, GLY123C, GLY123D, GLY124C, GLY124D, GLY285C, GLY285D, GLY309C, GLY309D, GLY311C, GLY311D, ILE271C, ILE271D, ILE277C, ILE277D, ILE280C, ILE280D, ILE85C, ILE85D, ILE88C, ILE88D, LEU107C, LEU107D, LEU110C, LEU110D, LEU114C, LEU114D, LEU121C, LEU121D, LEU122C, LEU122D, LEU253C, LEU253D, LEU275C, LEU275D, LEU286C, LEU286D, LEU308C, LEU308D, LYS125C, LYS125D, LYS247C, LYS247D, LYS255C, LYS255D, LYS343C, LYS343D, PHE248C, PHE248D, PHE86C, PHE86D, SER111C, SER111D, SER272C, SER272D, SER283C, SER283D, SER284C, SER284D, THR116C, THR116D, THR246C, THR246D, THR310C, THR310D, TYR120C, TYR120D, TYR82C, TYR82D, VAL118C, VAL118D, VAL250C, VAL250D, VAL254C, VAL254D, VAL278C, VAL278D, VAL342C, VAL342D, VAL79C, VAL79D