1T5K

crystal structure of amicyanin substituted with cobalt

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 37
  • Norm. En. per Res.: -2.4463
• 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	-15.1793	-8.8373	-59.3179	-83.3345	38	1	2	2520	1	16	6
A-C	-2.2066	71.6318	-60.9201	8.5051	51	2	1	3601	0	35	33
A-D	-23.8234	-4.0634	-62.625	-90.5118	37	2	0	2021	2	7	14
B-C	-25.5585	12.1061	-51.7424	-65.1948	36	2	0	1823	2	7	13
C-D	0.0	-12.951	-53.7977	-66.7487	37	1	1	2320	0	12	4

Interface residues

• A-B: ALA12B, ALA13B, ALA14B, ALA17B, ALA20B, ALA77B, ARG99A, ASP18B, GLU15B, GLU31A, GLU49A, GLU8B, GLY19B, HIS53A, HIS91A, HIS95A, ILE5B, LYS27A, LYS29A, MET28A, MET98A, PHE11B, PHE97A, PRO10B, PRO33A, PRO6B, PRO94A, PRO96A, SER79B, SER7B, SER9B, THR42B, THR44B, THR4B, THR81B, TYR30A, TYR78B, VAL16B
• A-C: ALA13A, ALA13C, ALA20C, ALA26A, ALA26C, ARG48A, ARG48C, ASN47C, ASP18C, ASP24A, ASP24C, GLU105A, GLU105C, GLU31A, GLU31C, GLU34A, GLU34C, GLU49A, GLU49C, GLU75A, GLU75C, GLY19C, HIS36A, HIS36C, ILE21A, ILE21C, ILE25A, ILE25C, ILE46A, ILE46C, LEU35A, LEU35C, LYS101A, LYS27A, LYS27C, LYS29A, LYS29C, LYS74A, LYS74C, PRO33A, PRO33C, THR32A, THR32C, TYR30A, TYR30C, VAL103C, VAL22A, VAL22C, VAL23A, VAL23C, VAL37C
• A-D: ALA12A, ALA13A, ALA14A, ALA17A, ALA17D, ALA20A, ALA20D, ALA77A, ARG48A, ARG48D, ASP18A, ASP18D, ASP24A, ASP24D, ASP41D, GLU15A, GLU75A, GLY19A, GLY19D, ILE21A, ILE21D, ILE46A, LEU35D, LYS38A, LYS38D, PHE11A, THR32D, THR42D, THR44A, THR44D, VAL16A, VAL16D, VAL22A, VAL22D, VAL23D, VAL37D, VAL43D
• B-C: ALA13B, ALA14B, ALA14C, ALA17B, ALA17C, ALA20B, ALA20C, ALA77B, ARG48B, ARG48C, ASP18B, ASP18C, ASP24B, ASP24C, ASP41B, ASP41C, GLU15B, GLU75B, GLY19B, GLY19C, ILE21B, ILE21C, ILE46B, LEU35C, LYS38B, LYS38C, THR32C, THR44B, THR44C, VAL16B, VAL16C, VAL22B, VAL22C, VAL23B, VAL23C, VAL37C
• C-D: ALA12D, ALA14D, ALA17D, ALA77D, ARG99C, ASP18D, GLU15D, GLU49C, GLU8D, GLY40D, HIS53C, HIS91C, HIS95C, ILE5D, LYS101C, LYS27C, LYS29C, MET28C, MET51C, MET98C, PHE11D, PHE97C, PRO10D, PRO33C, PRO6D, PRO94C, PRO96C, SER79D, SER7D, SER9D, THR42D, THR44D, THR4D, THR81D, TYR30C, TYR78D, VAL16D