3RZW

crystal structure of the monobody ysmb-9 bound to human sumo1

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 54
  • Norm. En. per Res.: -4.5955
• Hub Node: B(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-D	-31.6792	-25.7084	-190.771	-248.1586	54	3	4	6233	2	17	4
B-C	-25.1298	-13.4665	-185.185	-223.7813	54	6	4	6132	0	17	5
B-D	0.0	-11.1703	-4.7639	-15.9342	9	0	0	249	1	5	5

Interface residues

• A-D: ALA24A, ALA52D, ARG54D, ASN78A, ASP30A, ASP77A, GLN53D, GLN55D, GLU20D, GLU33D, GLU49D, GLU84D, GLU85D, GLY25A, GLY52A, GLY80A, HIS35D, HIS43D, ILE22D, ILE27D, ILE29A, ILE34D, LEU24D, LEU44D, LEU47D, LYS23D, LYS25D, LYS37D, LYS39D, LYS45D, LYS46D, LYS48D, PHE28A, PHE36D, PRO51A, SER31D, SER32D, SER50D, SER54A, THR42D, TRP27A, TRP81A, TYR21D, TYR26A, TYR31A, TYR32A, TYR51D, TYR53A, TYR75A, TYR76A, TYR79A, VAL26D, VAL38D, VAL4A
• B-C: ALA24B, ALA52C, ARG54C, ASN78B, ASP30B, ASP77B, GLN53C, GLN55C, GLU20C, GLU33C, GLU49C, GLU84C, GLU85C, GLY25B, GLY52B, GLY80B, HIS35C, HIS43C, ILE22C, ILE27C, ILE29B, ILE34C, LEU24C, LEU44C, LEU47C, LYS23C, LYS25C, LYS37C, LYS39C, LYS45C, LYS46C, LYS48C, PHE28B, PHE36C, PRO51B, SER31C, SER32C, SER50C, SER54B, THR42C, TRP27B, TRP81B, TYR21C, TYR26B, TYR31B, TYR32B, TYR51C, TYR53B, TYR75B, TYR76B, TYR79B, VAL26C, VAL38C, VAL4B
• B-D: GLU20D, GLU9B, LEU8B, LYS39D, LYS78D, LYS7B, THR41D, VAL10B, VAL11B