2IGT

crystal structure of the sam dependent methyltransferase from agrobacterium tumefaciens

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 68
  • Norm. En. per Res.: -4.1239
• 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	-52.2358	-49.3155	-176.642	-278.1933	70	5	2	6910	4	28	28
A-C	-44.059	-41.7458	-139.962	-225.7668	66	4	2	5931	4	28	26
B-C	-57.698	-50.6284	-172.102	-280.4284	68	4	2	6798	4	28	27

Interface residues

• A-B: ALA106A, ALA162B, ALA191B, ALA64A, ALA86A, ARG197B, ARG200B, ARG201B, ARG217B, ARG45A, ARG79A, ARG81A, ASN-5B, ASP190B, ASP228B, ASP235B, ASP65A, ASP71A, GLN-1B, GLN196B, GLN225B, GLN62A, GLU198B, GLU199B, GLU222B, GLU85A, GLU89A, GLY0B, GLY216B, GLY218B, GLY221B, GLY70A, GLY76A, GLY78A, GLY88A, HIS220B, HIS229B, ILE195B, ILE236B, ILE67A, LEU-4B, LEU232B, LEU33A, LEU87A, LYS165A, LYS193B, LYS84A, PHE-2B, PHE104A, PHE107A, PHE140B, PHE194B, PHE215B, PHE68A, PHE82A, PRO46A, PRO83A, THR105A, THR219B, THR69A, THR72A, THR90A, TRP169A, TRP224B, TRP61A, TRP80A, TYR-3B, TYR41A, VAL223B, VAL44A
• A-C: ALA106C, ALA162A, ALA191A, ALA64C, ALA86C, ARG197A, ARG200A, ARG201A, ARG217A, ARG79C, ARG81C, ASN-5A, ASP190A, ASP228A, ASP235A, ASP65C, ASP71C, ASP75C, GLN-1A, GLN196A, GLN225A, GLN62C, GLU199A, GLU222A, GLU85C, GLU89C, GLY0A, GLY216A, GLY218A, GLY221A, GLY70C, GLY76C, GLY78C, GLY88C, HIS220A, HIS229A, ILE195A, ILE236A, ILE67C, LEU-4A, LEU232A, LEU33C, LEU87C, LYS165C, LYS193A, LYS84C, PHE-2A, PHE104C, PHE107C, PHE140A, PHE194A, PHE68C, PHE82C, PRO46C, PRO83C, THR105C, THR219A, THR69C, THR90C, TRP169C, TRP224A, TRP61C, TRP80C, TYR-3A, VAL223A, VAL44C
• B-C: ALA106B, ALA162C, ALA191C, ALA64B, ALA86B, ARG103B, ARG197C, ARG200C, ARG201C, ARG217C, ARG79B, ARG81B, ASN-5C, ASP190C, ASP228C, ASP235C, ASP58B, ASP65B, ASP71B, GLN-1C, GLN196C, GLN225C, GLN62B, GLU198C, GLU199C, GLU222C, GLU85B, GLU89B, GLY0C, GLY216C, GLY218C, GLY221C, GLY70B, GLY76B, GLY78B, GLY88B, HIS220C, HIS229C, ILE195C, ILE236C, ILE67B, LEU-4C, LEU232C, LEU33B, LEU87B, LYS165B, LYS193C, LYS84B, PHE-2C, PHE104B, PHE107B, PHE140C, PHE194C, PHE68B, PHE82B, PRO46B, PRO83B, THR105B, THR219C, THR69B, THR90B, TRP169B, TRP224C, TRP61B, TRP80B, TYR-3C, VAL223C, VAL44B