3LWS

crystal structure of putative aromatic amino acid beta- eliminating lyase/threonine aldolase. (yp_001813866.1) from exiguobacterium sp. 255-15 at 2.00 a resolution

• Total interactions analyzed: 15
• Total true interactions: 8
• Strongest Interaction:
  • Chains: B-F
  • Int. Res.: 4
  • Norm. En. per Res.: -8.6716
• 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	-104.7088	-119.1371	-602.979	-826.8249	159	14	18	23644	2	59	40
A-C	0.0	10.0834	-5.9625	4.1208	19	0	0	481	0	7	11
A-E	-13.7947	-18.6341	-4.9267	-37.3555	6	1	0	199	2	2	1
A-F	0.0	0.0	-0.0112	-0.0112	2	0	0	1	0	0	6
B-E	0.0	41.3085	-35.4253	5.8832	15	0	7	1240	0	4	4
B-F	-11.2734	-18.8265	-4.5865	-34.6864	4	1	0	184	2	2	1
C-D	-137.0	-127.9034	-596.167	-861.0704	160	16	18	23386	6	59	40
E-F	-120.2755	-128.5528	-595.33	-844.1583	161	15	17	23564	5	59	40

Interface residues

• A-B: ALA211A, ALA211B, ALA213B, ALA29A, ALA29B, ALA31A, ALA31B, ALA32A, ALA32B, ALA34A, ALA34B, ALA38A, ALA38B, ALA46A, ALA46B, ALA73A, ALA73B, ARG145A, ARG145B, ARG177A, ARG177B, ARG21A, ARG21B, ARG226A, ARG226B, ARG230A, ARG230B, ARG231A, ARG231B, ARG5B, ARG79A, ARG79B, ASN22A, ASN22B, ASP104A, ASP104B, ASP235A, ASP235B, ASP35A, ASP35B, ASP40A, ASP40B, ASP83B, GLN103A, GLN103B, GLN41A, GLN41B, GLN74A, GLN74B, GLN75A, GLN75B, GLN9B, GLU102A, GLU102B, GLU108A, GLU108B, GLU36A, GLU36B, GLY105A, GLY105B, GLY209A, GLY209B, GLY212A, GLY212B, GLY233A, GLY233B, GLY234A, GLY234B, GLY24A, GLY24B, GLY70A, GLY70B, HIS101A, HIS101B, HIS110A, HIS110B, HIS97A, HIS97B, ILE100A, ILE100B, ILE210A, ILE210B, ILE227A, ILE227B, ILE237A, ILE237B, ILE243A, ILE243B, ILE47A, ILE47B, LEU106A, LEU106B, LEU109A, LEU109B, LEU236A, LEU236B, LEU239A, LEU239B, LEU26A, LEU26B, LEU98A, LEU98B, LYS107A, LYS107B, LYS20A, LYS20B, LYS229A, LYS229B, LYS27A, LYS27B, PHE30A, PHE30B, PHE66A, PHE66B, PHE67A, PHE67B, PRO111A, PRO111B, PRO241A, PRO241B, PRO68A, PRO68B, SER202B, SER238A, SER238B, SER245A, SER245B, SER39A, SER39B, SER69A, SER69B, THR28A, THR28B, THR71A, THR71B, TRP228A, TRP228B, TYR204A, TYR204B, TYR232A, TYR232B, TYR240A, TYR240B, TYR242A, TYR242B, TYR249A, TYR249B, TYR42A, TYR42B, VAL23A, VAL23B, VAL244A, VAL244B, VAL25A, VAL25B, VAL33A, VAL33B, VAL76A, VAL76B
• A-C: ALA153C, ARG344A, ASP340A, ASP345A, GLN266A, GLN270A, GLN341A, GLN342A, GLU156C, GLU158C, GLU186C, GLU191C, GLU262A, GLU269A, LYS187C, PHE154C, SER155C, THR188C, TYR185C
• A-E: ALA34E, ASP35E, GLU36E, LYS27A, VAL23A, VAL33E
• A-F: ASP35A, GLN10F
• B-E: ALA31B, ALA31E, ALA32B, ALA32E, ALA34B, ALA34E, ASP35B, ASP35E, GLU36B, GLU36E, LYS27E, PHE30B, PHE30E, VAL33B, VAL33E
• B-F: ALA34B, ASP35B, GLU36B, LYS27F
• C-D: ALA211C, ALA211D, ALA213C, ALA29C, ALA29D, ALA31C, ALA31D, ALA32C, ALA32D, ALA34C, ALA34D, ALA38C, ALA38D, ALA46C, ALA46D, ALA73C, ALA73D, ARG145C, ARG145D, ARG177C, ARG177D, ARG21C, ARG21D, ARG226C, ARG226D, ARG230C, ARG230D, ARG231C, ARG231D, ARG5D, ARG79C, ARG79D, ASN22C, ASN22D, ASP104C, ASP104D, ASP235C, ASP235D, ASP35C, ASP35D, ASP40C, ASP40D, ASP83C, ASP83D, GLN103C, GLN103D, GLN41C, GLN41D, GLN74C, GLN74D, GLN75C, GLN75D, GLN9C, GLN9D, GLU102C, GLU102D, GLU108C, GLU108D, GLU36C, GLU36D, GLY105C, GLY105D, GLY209C, GLY209D, GLY212C, GLY212D, GLY233C, GLY233D, GLY234C, GLY234D, GLY24C, GLY24D, GLY70C, GLY70D, HIS101C, HIS101D, HIS110C, HIS110D, HIS97C, HIS97D, ILE100C, ILE100D, ILE210C, ILE210D, ILE227C, ILE227D, ILE237C, ILE237D, ILE243C, ILE243D, ILE47C, ILE47D, LEU106C, LEU106D, LEU109C, LEU109D, LEU236C, LEU236D, LEU239C, LEU239D, LEU26C, LEU26D, LYS107C, LYS107D, LYS20C, LYS20D, LYS229C, LYS229D, LYS27C, LYS27D, PHE30C, PHE30D, PHE66C, PHE66D, PHE67C, PHE67D, PRO111C, PRO111D, PRO241C, PRO241D, PRO68C, PRO68D, SER202C, SER202D, SER238C, SER238D, SER245C, SER245D, SER39C, SER39D, SER69C, SER69D, THR28C, THR28D, THR71C, THR71D, TRP228C, TRP228D, TYR204C, TYR204D, TYR232C, TYR232D, TYR240C, TYR240D, TYR242C, TYR242D, TYR249C, TYR249D, TYR42C, TYR42D, VAL23C, VAL23D, VAL244C, VAL244D, VAL25C, VAL25D, VAL33C, VAL33D, VAL76C, VAL76D
• E-F: ALA211E, ALA211F, ALA213F, ALA29E, ALA29F, ALA31E, ALA31F, ALA32E, ALA32F, ALA34E, ALA34F, ALA38E, ALA38F, ALA46E, ALA46F, ALA73E, ALA73F, ARG145E, ARG145F, ARG177E, ARG177F, ARG21E, ARG21F, ARG226E, ARG226F, ARG230E, ARG230F, ARG231E, ARG231F, ARG5E, ARG5F, ARG79E, ARG79F, ASN22E, ASN22F, ASP104E, ASP104F, ASP235E, ASP235F, ASP35E, ASP35F, ASP40E, ASP40F, ASP83E, ASP83F, GLN103E, GLN103F, GLN41E, GLN41F, GLN74E, GLN74F, GLN75E, GLN75F, GLN9E, GLN9F, GLU102E, GLU102F, GLU108E, GLU108F, GLU36E, GLU36F, GLY105E, GLY105F, GLY209E, GLY209F, GLY212E, GLY212F, GLY233E, GLY233F, GLY234E, GLY234F, GLY24E, GLY24F, GLY70E, GLY70F, HIS101E, HIS101F, HIS110E, HIS110F, HIS97E, HIS97F, ILE100E, ILE100F, ILE210E, ILE210F, ILE227E, ILE227F, ILE237E, ILE237F, ILE243E, ILE243F, ILE47E, ILE47F, LEU106E, LEU106F, LEU109E, LEU109F, LEU236E, LEU236F, LEU239E, LEU239F, LEU26E, LEU26F, LYS107E, LYS107F, LYS20E, LYS20F, LYS229E, LYS229F, LYS27E, LYS27F, PHE30E, PHE30F, PHE66E, PHE66F, PHE67E, PHE67F, PRO111E, PRO111F, PRO241E, PRO241F, PRO68E, PRO68F, SER202F, SER238E, SER238F, SER245E, SER245F, SER39E, SER39F, SER69E, SER69F, THR224E, THR28E, THR28F, THR71E, THR71F, TRP228E, TRP228F, TYR204E, TYR204F, TYR232E, TYR232F, TYR240E, TYR240F, TYR242E, TYR242F, TYR249E, TYR249F, TYR42E, TYR42F, VAL23E, VAL23F, VAL244E, VAL244F, VAL25E, VAL25F, VAL33E, VAL33F, VAL76E, VAL76F