3N52

crystal structure analysis of mip2

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 60
  • Norm. En. per Res.: -4.6412
• Hub Node: A(3)

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	-52.4814	-4.6103	-249.312	-306.4037	91	8	9	11312	0	15	5
A-C	-64.6288	23.6663	-237.511	-278.4735	60	24	2	8064	0	13	15
A-D	0.0	0.0	-20.2902	-20.2902	18	0	0	773	0	0	4
B-C	0.0	0.0	-21.6151	-21.6151	18	0	0	816	0	0	4
B-D	-52.6298	-8.3885	-124.057	-185.0753	52	12	9	6146	0	6	9
C-D	-65.9917	0.0	-254.986	-320.9777	90	12	8	11192	0	12	6

Interface residues

• A-B: ALA36A, ALA36B, ALA42A, ALA42B, ALA56A, ALA56B, ALA72B, ASN22A, ASN22B, ASN68A, ASN68B, ASP53A, ASP53B, CYS35B, GLN10B, GLN24A, GLN24B, GLN37A, GLN37B, GLN60A, GLN60B, GLN64A, GLN64B, GLU39A, GLU39B, GLU55A, GLU55B, GLU6B, GLY32A, GLY32B, GLY70A, GLY70B, HIS34A, HIS34B, ILE23A, ILE23B, ILE41A, ILE41B, ILE62A, ILE62B, ILE63A, ILE63B, ILE66A, ILE66B, LEU26A, LEU26B, LEU52A, LEU52B, LEU67A, LEU67B, LYS21A, LYS21B, LYS45A, LYS45B, LYS61A, LYS61B, LYS65A, LYS65B, LYS69A, LYS69B, LYS71A, LYS71B, PHE20A, PHE20B, PRO30A, PRO30B, PRO31A, PRO31B, PRO33A, PRO33B, PRO54A, PRO54B, PRO57A, PRO57B, SER25A, SER25B, SER27A, SER27B, THR29A, THR29B, THR38A, THR38B, THR43A, THR43B, VAL28A, VAL28B, VAL3B, VAL40A, VAL40B, VAL59A, VAL59B
• A-C: ALA36A, ALA36C, ALA42A, ALA42C, ARG17C, ARG8A, ARG8C, ASP53C, CYS11A, CYS11C, CYS35A, CYS35C, CYS51A, CYS51C, CYS9A, CYS9C, GLN10A, GLN10C, GLN37A, GLN37C, GLN48A, GLN48C, GLU39A, GLU39C, GLU6A, GLU6C, HIS34A, HIS34C, ILE41A, ILE41C, LEU12A, LEU12C, LEU15A, LEU15C, LEU44C, LEU52A, LEU52C, LEU7A, LEU7C, LYS13A, LYS13C, LYS49A, LYS49C, PRO16C, PRO33A, PRO33C, SER27A, SER27C, SER5A, SER5C, THR14A, THR14C, THR29A, THR29C, THR43A, VAL18C, VAL40A, VAL40C, VAL50A, VAL50C
• A-D: GLN24A, GLN24D, GLN48A, GLN48D, GLY46A, GLY46D, GLY47A, GLY47D, LEU44A, LEU44D, LYS45A, LYS45D, LYS49A, LYS49D, SER25A, SER25D, THR43A, THR43D
• B-C: GLN24B, GLN24C, GLN48B, GLN48C, GLY46B, GLY46C, GLY47B, GLY47C, LEU44B, LEU44C, LYS45B, LYS45C, LYS49B, LYS49C, SER25B, SER25C, THR43B, THR43C
• B-D: ALA1D, ALA42B, ALA42D, ALA4B, ALA4D, ARG8B, ARG8D, CYS11B, CYS11D, CYS51B, CYS51D, CYS9B, CYS9D, GLN10B, GLN10D, GLN48B, GLN48D, GLU39B, GLU39D, GLU6B, GLU6D, GLY47B, GLY47D, ILE41B, ILE41D, LEU12B, LEU12D, LEU15B, LEU15D, LEU44B, LEU52B, LEU52D, LEU7B, LEU7D, LYS13B, LYS13D, LYS49B, LYS49D, SER5B, SER5D, THR14B, THR14D, THR43B, THR43D, VAL2B, VAL2D, VAL3B, VAL3D, VAL40B, VAL40D, VAL50B, VAL50D
• C-D: ALA36C, ALA36D, ALA42C, ALA42D, ALA56C, ALA56D, ASN22C, ASN22D, ASN68C, ASN68D, ASP53C, ASP53D, CYS35C, CYS35D, GLN24C, GLN24D, GLN37C, GLN37D, GLN60C, GLN60D, GLN64C, GLN64D, GLU39C, GLU39D, GLU55C, GLU55D, GLU6D, GLY32C, GLY32D, GLY70C, GLY70D, HIS34C, HIS34D, ILE23C, ILE23D, ILE41C, ILE41D, ILE62C, ILE62D, ILE63C, ILE63D, ILE66C, ILE66D, LEU26C, LEU26D, LEU52C, LEU52D, LEU67C, LEU67D, LEU7C, LYS21C, LYS21D, LYS45C, LYS45D, LYS61C, LYS61D, LYS65C, LYS65D, LYS69C, LYS69D, LYS71C, PHE20C, PHE20D, PRO30C, PRO30D, PRO31C, PRO31D, PRO33C, PRO33D, PRO54C, PRO54D, PRO57C, PRO57D, SER25C, SER25D, SER27C, SER27D, SER5D, THR29C, THR29D, THR38C, THR38D, THR43C, THR43D, VAL28C, VAL28D, VAL40C, VAL40D, VAL59C, VAL59D