2PL6

monoclinic crystal structure of hydrophobin hfbii in presence of a detergent

• Total interactions analyzed: 28
• Total true interactions: 13
• Strongest Interaction:
  • Chains: C-H
  • Int. Res.: 41
  • Norm. En. per Res.: -2.477
• Hub Node: A(4)

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	0.0	-2.8059	-46.7453	-49.5512	34	1	8	2603	0	4	1
A-C	-19.5813	0.0	-73.9269	-93.5082	43	15	4	3704	0	4	3
A-E	0.0	0.0	-0.0296	-0.0296	8	0	0	30	0	0	1
A-F	-9.9709	0.0	-77.2558	-87.2267	45	8	4	3717	0	3	3
B-C	0.0	0.0	-0.026	-0.026	11	0	0	27	0	0	1
B-D	-9.4578	0.0	-84.6808	-94.1386	43	6	4	3660	0	3	3
B-E	-24.6287	0.0	-78.874	-103.5027	43	11	4	3474	0	3	3
C-D	0.0	0.0	-49.5276	-49.5276	35	0	9	2664	0	4	1
C-H	-25.7818	0.0	-75.7771	-101.5589	41	4	4	3494	0	3	3
D-G	-16.0249	0.8305	-87.2918	-102.4862	45	10	4	3925	0	5	4
D-H	0.0	0.0	-0.0392	-0.0392	7	0	0	36	0	0	1
E-F	0.0	-4.2856	-47.5572	-51.8428	34	0	8	2661	0	4	1
G-H	0.0	-2.4402	-38.3993	-40.8396	32	0	9	2435	0	4	1

Interface residues

• A-B: ALA32A, ALA32B, ALA37A, ALA37B, ALA41A, ALA41B, ALA44A, ALA44B, ASP34A, ASP34B, CYS43A, CYS43B, GLN40A, GLN40B, GLY36A, GLY36B, GLY47A, GLY47B, HIS42A, HIS42B, ILE31A, ILE31B, ILE38A, ILE38B, LYS46A, LYS46B, PHE39A, PHE39B, SER45A, SER45B, THR35A, THR35B, VAL33A, VAL33B
• A-C: ALA15A, ALA1C, ALA41A, ALA44A, ALA67C, ASN17A, ASP25A, CYS13A, CYS14A, CYS3C, CYS43A, CYS52C, CYS64C, GLN40A, GLN60A, GLN65C, GLY36C, GLY47A, GLY69C, GLY6C, ILE68C, LEU19A, LEU21C, LEU63C, LEU7C, LYS27A, LYS46A, LYS49A, LYS66C, PHE71A, PHE8C, PRO4C, PRO50A, SER45A, SER48A, SER9C, THR16A, THR5C, THR70A, THR70C, VAL18A, VAL24A, VAL2C
• A-E: ALA1A, ALA1E, ASP34A, ASP34E, GLY36A, GLY36E, THR35A, THR35E
• A-F: ALA15F, ALA1A, ALA41F, ALA44F, ALA67A, ASN17F, ASP20A, ASP25F, CYS13F, CYS14F, CYS26F, CYS3A, CYS43F, CYS52A, CYS64A, GLN40F, GLN65A, GLY36A, GLY47F, GLY69A, GLY6A, ILE68A, LEU19F, LEU21A, LEU63A, LEU7A, LYS27F, LYS46F, LYS49F, LYS66A, PHE71F, PHE8A, PRO4A, PRO50F, SER45F, SER48F, SER9A, THR16F, THR35A, THR5A, THR70F, VAL18F, VAL24F, VAL2A, VAL54A
• B-C: ALA1B, ALA1C, ALA37B, ALA37C, ASP34C, GLY36B, GLY36C, GLY69B, GLY69C, THR35B, THR35C
• B-D: ALA15D, ALA1B, ALA41D, ALA44D, ALA67B, ASN17D, ASP25D, CYS13D, CYS14D, CYS26D, CYS3B, CYS43D, CYS52B, CYS64B, GLN40D, GLN65B, GLY47D, GLY69B, GLY6B, ILE68B, LEU19D, LEU21B, LEU63B, LEU7B, LYS27D, LYS46D, LYS49D, LYS66B, PHE71B, PHE71D, PHE8B, PRO4B, PRO50D, SER45D, SER48D, SER9B, THR16D, THR5B, THR70B, THR70D, VAL18D, VAL24D, VAL2B
• B-E: ALA15B, ALA1E, ALA41B, ALA44B, ALA67E, ASN17B, ASP25B, ASP34E, CYS13B, CYS14B, CYS26B, CYS3E, CYS43B, CYS52E, GLN40B, GLN65E, GLY36E, GLY47B, GLY69E, GLY6E, ILE68E, LEU19B, LEU21E, LEU63E, LEU7E, LYS27B, LYS46B, LYS49B, LYS66E, PHE71B, PHE8E, PRO4E, PRO50B, SER45B, SER48B, SER9E, THR16B, THR35E, THR5E, THR70E, VAL18B, VAL24B, VAL2E
• C-D: ALA32C, ALA32D, ALA37C, ALA37D, ALA41C, ALA41D, ALA44C, ALA44D, ASP34C, ASP34D, CYS43C, CYS43D, GLN40C, GLN40D, GLY36C, GLY36D, GLY47C, GLY47D, HIS42C, HIS42D, ILE31C, ILE31D, ILE38C, ILE38D, LYS46C, LYS46D, PHE39C, PHE39D, SER45C, SER45D, THR30D, THR35C, THR35D, VAL33C, VAL33D
• C-H: ALA15C, ALA1H, ALA41C, ALA44C, ALA67H, ASN17C, ASP25C, CYS13C, CYS14C, CYS3H, CYS43C, CYS52H, GLN40C, GLN65H, GLY36H, GLY47C, GLY69H, GLY6H, ILE68H, LEU19C, LEU21H, LEU63H, LEU7H, LYS27C, LYS46C, LYS49C, LYS66H, PHE71C, PHE8H, PRO4H, PRO50C, SER45C, SER48C, SER9H, THR16C, THR35H, THR5H, THR70H, VAL18C, VAL24C, VAL2H
• D-G: ALA15G, ALA1D, ALA41G, ALA44G, ALA67D, ASN17G, ASP20D, ASP25G, CYS13G, CYS14G, CYS26G, CYS3D, CYS43G, CYS52D, CYS64D, GLN40G, GLN65D, GLY36D, GLY47G, GLY69D, GLY6D, ILE68D, LEU19G, LEU21D, LEU63D, LEU7D, LYS27G, LYS46G, LYS49G, LYS66D, PHE71G, PHE8D, PRO4D, PRO50G, SER45G, SER48G, SER9D, THR16G, THR35D, THR5D, THR70D, THR70G, VAL18G, VAL24G, VAL2D
• D-H: ALA1D, ALA1H, ASP34D, GLY36D, GLY36H, THR35D, THR35H
• E-F: ALA32E, ALA32F, ALA37E, ALA37F, ALA41E, ALA41F, ALA44E, ALA44F, ASP34E, ASP34F, CYS43E, CYS43F, GLN40E, GLN40F, GLY36E, GLY36F, GLY47E, GLY47F, HIS42E, HIS42F, ILE31E, ILE31F, ILE38E, ILE38F, LYS46E, LYS46F, PHE39E, PHE39F, SER45E, SER45F, THR35E, THR35F, VAL33E, VAL33F
• G-H: ALA32G, ALA32H, ALA37G, ALA37H, ALA41G, ALA41H, ALA44G, ALA44H, ASP34G, ASP34H, CYS43G, CYS43H, GLN40G, GLN40H, GLY36G, GLY36H, HIS42G, HIS42H, ILE31G, ILE31H, ILE38G, ILE38H, LYS46G, LYS46H, PHE39G, PHE39H, SER45G, SER45H, THR35G, THR35H, VAL33G, VAL33H