1MO1

crystal structure at 1.8 angstroms of seleno methionyled crh, the bacillus subtilis catabolite repression containing protein crh reveals an unexpected swapping domain as an untertwinned dimer

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 128
  • Norm. En. per Res.: -8.0794
• 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	-320.833	3.5829	-716.915	-1034.1651	128	34	22	24672	1	22	19
A-C	-13.664	0.0	-12.7141	-26.3781	14	0	1	765	0	0	1
A-D	-7.7979	1.4537	-68.4403	-74.7845	40	2	0	3413	0	7	14
B-C	-7.8006	-1.4568	-66.5144	-75.7718	39	4	0	3277	0	7	14
C-D	-302.974	-1.4995	-714.902	-1019.3755	130	32	22	24650	1	22	19

Interface residues

• A-B: ALA16A, ALA16B, ALA19A, ALA19B, ALA20A, ALA20B, ALA54A, ALA54B, ALA65A, ALA65B, ALA73A, ALA73B, ALA78A, ALA78B, ALA79A, ALA79B, ARG17A, ARG17B, ARG9A, ARG9B, ASP32B, ASP38A, ASP38B, ASP69A, ASP69B, GLN15A, GLN15B, GLN3A, GLN3B, GLN4A, GLN4B, GLN66A, GLN66B, GLN71A, GLN71B, GLN82A, GLN82B, GLU36A, GLU36B, GLU60A, GLU60B, GLU70A, GLU70B, GLU72A, GLU72B, GLU75A, GLU75B, GLU7A, GLU7B, GLU83A, GLU83B, GLU84A, GLU84B, GLY13A, GLY13B, GLY49A, GLY58A, GLY58B, GLY67A, GLY67B, ILE64A, ILE64B, LEU10A, LEU10B, LEU14A, LEU14B, LEU21A, LEU21B, LEU35A, LEU35B, LEU50A, LEU50B, LEU53A, LEU53B, LEU63A, LEU63B, LEU74A, LEU74B, LEU77A, LEU77B, LYS11A, LYS11B, LYS37A, LYS37B, LYS40A, LYS41A, LYS5A, LYS5B, MET1A, PHE22A, PHE22B, PHE34A, PHE34B, PRO18A, PRO18B, SER31A, SER31B, SER52A, SER52B, SER56A, SER56B, THR12A, THR12B, THR57A, THR57B, THR59A, THR59B, THR62A, THR62B, TYR80A, TYR80B, VAL2A, VAL2B, VAL33A, VAL33B, VAL42A, VAL42B, VAL55A, VAL55B, VAL61A, VAL61B, VAL6A, VAL6B, VAL81A, VAL81B, VAL85A, VAL8A, VAL8B
• A-C: ALA16A, ALA16C, ALA20A, ALA20C, ARG17A, ARG17C, GLN15A, GLN15C, GLN24A, GLN24C, LEU21A, LEU21C, PRO18A, PRO18C
• A-D: ALA16A, ALA19A, ALA20A, ALA26A, ALA44D, ALA54D, ARG17A, ARG28A, ASN27A, ASN43A, ASN43D, ASP32D, ASP38D, GLN24A, GLN66D, GLU25A, GLU36D, GLY13D, GLY39D, GLY49D, ILE47A, ILE47D, LEU21A, LEU35D, LEU50D, LEU53D, LYS11D, LYS40D, LYS41D, LYS45A, LYS76A, PHE29A, PHE34D, SER46A, SER46D, SER52D, THR30A, VAL23A, VAL33D, VAL42D
• B-C: ALA16C, ALA19C, ALA20C, ALA26C, ALA44B, ALA54B, ARG17C, ARG28C, ASN27C, ASN43B, ASN43C, ASP32B, GLN24C, GLN66B, GLU25C, GLU36B, GLY13B, GLY39B, GLY49B, ILE47B, ILE47C, LEU21C, LEU35B, LEU50B, LEU53B, LYS11B, LYS40B, LYS41B, LYS45C, PHE29C, PHE34B, SER46B, SER46C, SER52B, THR12B, THR30C, VAL23C, VAL33B, VAL42B
• C-D: ALA16C, ALA16D, ALA19C, ALA19D, ALA20C, ALA20D, ALA54C, ALA54D, ALA65C, ALA65D, ALA73C, ALA73D, ALA78C, ALA78D, ALA79C, ALA79D, ARG17C, ARG17D, ARG9C, ARG9D, ASP32D, ASP38C, ASP38D, ASP69C, ASP69D, GLN15C, GLN15D, GLN3C, GLN3D, GLN4C, GLN4D, GLN66C, GLN66D, GLN71C, GLN71D, GLN82C, GLN82D, GLU36C, GLU36D, GLU60C, GLU60D, GLU70C, GLU70D, GLU72C, GLU72D, GLU75C, GLU75D, GLU7C, GLU7D, GLU83C, GLU83D, GLU84C, GLU84D, GLY13C, GLY13D, GLY49C, GLY58C, GLY58D, GLY67C, GLY67D, ILE64C, ILE64D, LEU10C, LEU10D, LEU14C, LEU14D, LEU21C, LEU21D, LEU35C, LEU35D, LEU50C, LEU50D, LEU53C, LEU53D, LEU63C, LEU63D, LEU74C, LEU74D, LEU77C, LEU77D, LYS11C, LYS11D, LYS37C, LYS37D, LYS40C, LYS41C, LYS41D, LYS5C, LYS5D, LYS76D, MET1C, PHE22C, PHE22D, PHE34C, PHE34D, PRO18C, PRO18D, SER31C, SER31D, SER52C, SER52D, SER56C, SER56D, THR12C, THR12D, THR57C, THR57D, THR59C, THR59D, THR62C, THR62D, TYR80C, TYR80D, VAL2C, VAL2D, VAL33C, VAL33D, VAL42C, VAL42D, VAL55C, VAL55D, VAL61C, VAL61D, VAL6C, VAL6D, VAL81C, VAL81D, VAL85C, VAL8C, VAL8D