2V4O

crystal structure of salmonella typhimurium sure at 2.75 angstrom resolution in monoclinic form

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 297
  • Norm. En. per Res.: -4.1917
• 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	-140.5268	-121.8136	-928.708	-1191.0484	302	48	45	38874	7	84	69
A-C	-12.0965	-43.0754	-95.0288	-150.2007	53	3	0	3457	2	6	8
A-D	-15.4811	-1.3284	-56.4745	-73.284	61	2	0	3043	0	19	22
B-C	-11.2758	13.65	-14.239	-11.8648	46	1	0	1280	0	13	17
B-D	-15.1034	-40.5233	-83.272	-138.8988	49	4	0	3318	1	7	9
C-D	-181.3134	-83.4032	-980.207	-1244.9236	297	43	44	39665	5	83	73

Interface residues

• A-B: ALA108A, ALA108B, ALA136A, ALA136B, ALA140A, ALA140B, ALA182A, ALA182B, ALA233A, ALA233B, ALA236A, ALA236B, ALA41A, ALA41B, ALA78A, ALA78B, ARG114A, ARG114B, ARG143A, ARG143B, ARG147A, ARG147B, ARG151A, ARG151B, ARG154A, ARG154B, ARG172A, ARG172B, ARG175A, ARG175B, ARG179A, ARG179B, ARG192A, ARG192B, ARG36A, ARG38A, ARG38B, ARG52A, ARG52B, ARG81A, ARG81B, ARG83A, ARG83B, ASN157A, ASN157B, ASN194A, ASN194B, ASN37A, ASN37B, ASN43A, ASN43B, ASN77A, ASN77B, ASP100A, ASP100B, ASP183A, ASP183B, ASP190A, ASP190B, ASP207A, ASP211A, ASP211B, ASP213A, ASP213B, ASP230A, ASP230B, ASP238A, ASP238B, ASP242A, ASP242B, ASP245A, ASP245B, ASP70A, ASP70B, ASP99A, ASP99B, ASP9A, CYS139A, CYS139B, CYS176A, CYS176B, CYS71A, CYS71B, GLN188A, GLN188B, GLN252B, GLN64A, GLN64B, GLU112A, GLU112B, GLU148A, GLU148B, GLU189A, GLU189B, GLU48A, GLU48B, GLY105A, GLY105B, GLY113B, GLY144A, GLY144B, GLY153A, GLY153B, GLY170A, GLY170B, GLY177A, GLY177B, GLY193A, GLY193B, GLY200A, GLY200B, GLY203A, GLY203B, GLY248A, GLY248B, GLY250A, GLY250B, GLY40A, GLY40B, GLY75A, GLY75B, GLY98A, GLY98B, HIS115A, HIS115B, HIS180A, HIS180B, HIS228A, HIS228B, HIS234A, HIS234B, HIS237A, HIS237B, ILE102A, ILE102B, ILE155A, ILE155B, ILE171A, ILE171B, ILE186A, ILE186B, ILE199A, ILE199B, ILE61A, ILE61B, LEU116A, LEU116B, LEU121A, LEU121B, LEU141A, LEU141B, LEU142A, LEU142B, LEU145A, LEU145B, LEU150A, LEU150B, LEU156A, LEU156B, LEU196A, LEU196B, LEU227A, LEU227B, LEU231A, LEU231B, LEU244A, LEU244B, LEU45A, LEU45B, LEU47A, LEU47B, LEU51A, LEU51B, LEU74A, LEU74B, LEU79A, LEU79B, LYS169A, LYS169B, LYS184A, LYS184B, MET111A, MET111B, MET1A, MET1B, MET65B, PHE118A, PHE118B, PHE54A, PHE54B, PRO119A, PRO119B, PRO149A, PRO149B, PRO181A, PRO181B, PRO187A, PRO187B, PRO191A, PRO191B, PRO201A, PRO201B, PRO202A, PRO202B, PRO226A, PRO226B, PRO68B, SER104A, SER104B, SER146A, SER146B, SER178A, SER178B, SER223A, SER223B, SER235A, SER235B, SER241A, SER241B, SER246A, SER246B, SER39A, SER39B, SER42A, SER42B, SER44A, SER44B, SER49A, SER49B, SER50A, SER50B, THR138A, THR138B, THR152A, THR152B, THR174A, THR174B, THR195A, THR195B, THR212A, THR212B, THR225A, THR225B, THR232A, THR232B, THR251A, THR251B, THR46A, THR46B, THR53A, THR53B, THR55B, THR67A, THR67B, THR69A, THR69B, TRP198A, TRP198B, TRP243A, TRP243B, TYR103A, TYR103B, TYR197A, TYR197B, TYR206A, TYR221A, TYR221B, TYR73A, TYR73B, VAL101A, VAL101B, VAL107A, VAL107B, VAL137A, VAL137B, VAL158A, VAL158B, VAL168A, VAL168B, VAL173A, VAL173B, VAL185A, VAL185B, VAL222A, VAL222B, VAL224A, VAL224B, VAL229A, VAL229B, VAL239A, VAL239B, VAL240A, VAL240B, VAL247A, VAL247B, VAL249A, VAL249B, VAL63A, VAL63B, VAL72B, VAL76A, VAL76B
• A-C: ARG192A, ARG192C, ARG52A, ARG52C, ASN194A, ASN194C, ASN37A, ASP190A, ASP190C, GLN188A, GLN188C, GLN64A, GLN64C, GLU189A, GLU189C, GLU48A, GLU48C, GLY193A, GLY193C, GLY200A, GLY200C, ILE186A, ILE186C, ILE199A, ILE199C, LEU196A, LEU196C, LEU47A, LEU47C, LEU51A, MET65A, MET65C, PHE54A, PRO187A, PRO187C, PRO191A, PRO191C, PRO201A, PRO201C, PRO202A, PRO202C, SER39A, SER49A, SER49C, SER50A, SER50C, THR195C, TRP198A, TRP198C, TYR128A, TYR128C, TYR197A, TYR197C
• A-D: ALA13A, ALA13D, ALA62A, ALA62D, ARG192A, ARG192D, ARG36A, ARG36D, ARG38A, ARG38D, ARG52A, ARG52D, ASN194D, ASN37A, ASN37D, ASP190A, ASP190D, ASP35A, ASP35D, ASP57A, ASP57D, ASP9A, ASP9D, GLN17A, GLN17D, GLN188A, GLN188D, GLN64A, GLN64D, GLU48A, GLU48D, GLY10A, GLY10D, HIS12A, HIS12D, LEU196A, LEU196D, LEU47A, LEU47D, MET65A, MET65D, PHE54A, PHE54D, PHE56A, PHE56D, PRO14A, PRO14D, PRO191A, PRO191D, SER49A, SER49D, SER50A, SER50D, THR46A, THR46D, THR55A, THR55D, TRP198A, TRP198D, VAL11A, VAL11D
• B-C: ARG192B, ARG192C, ARG36B, ARG36C, ARG38B, ARG52B, ARG52C, ASN194B, ASN194C, ASN37B, ASN37C, ASP190B, ASP190C, ASP35B, ASP35C, GLN188B, GLN188C, GLN64B, GLN64C, GLU48B, GLU48C, HIS12B, HIS12C, LEU196B, LEU196C, LEU47B, LEU47C, MET65B, MET65C, PHE54B, PHE54C, PHE56B, PHE56C, PRO14B, PRO14C, PRO191B, PRO191C, SER39B, SER49B, SER49C, SER50B, SER50C, THR46B, THR46C, TRP198B, TRP198C
• B-D: ARG192B, ARG192D, ARG52B, ARG52D, ASN194B, ASN194D, ASN37D, ASP190B, ASP190D, GLN188B, GLN188D, GLN64B, GLN64D, GLU189B, GLU189D, GLU48B, GLU48D, GLY193D, GLY200B, GLY200D, ILE186B, ILE186D, ILE199B, ILE199D, LEU196B, LEU196D, LEU47B, LEU47D, LEU51D, PHE54D, PRO187B, PRO187D, PRO191B, PRO191D, PRO201B, PRO201D, PRO202B, PRO202D, SER39D, SER49B, SER49D, SER50B, SER50D, THR195B, TRP198B, TRP198D, TYR197B, TYR197D, VAL185D
• C-D: ALA108C, ALA108D, ALA136C, ALA136D, ALA140C, ALA140D, ALA182C, ALA182D, ALA233C, ALA233D, ALA236C, ALA236D, ALA41C, ALA41D, ALA78C, ALA78D, ARG114C, ARG114D, ARG143C, ARG143D, ARG147C, ARG147D, ARG151C, ARG151D, ARG154C, ARG154D, ARG172C, ARG172D, ARG175C, ARG175D, ARG179C, ARG179D, ARG192C, ARG192D, ARG36D, ARG38C, ARG38D, ARG52C, ARG52D, ARG83C, ARG83D, ASN157C, ASN157D, ASN194C, ASN194D, ASN37C, ASN37D, ASN43C, ASN43D, ASN77C, ASN77D, ASP100C, ASP100D, ASP183C, ASP183D, ASP190C, ASP190D, ASP207D, ASP211C, ASP211D, ASP213C, ASP213D, ASP230C, ASP230D, ASP238C, ASP238D, ASP242C, ASP242D, ASP245C, ASP245D, ASP70C, ASP70D, ASP8D, ASP99C, ASP99D, ASP9D, CYS139C, CYS139D, CYS176C, CYS176D, GLN188C, GLN188D, GLN252D, GLN64C, GLN64D, GLU112C, GLU112D, GLU148C, GLU148D, GLU189C, GLU189D, GLU48C, GLU48D, GLY105C, GLY105D, GLY113C, GLY144C, GLY144D, GLY153C, GLY153D, GLY170C, GLY170D, GLY177C, GLY177D, GLY193C, GLY193D, GLY200C, GLY200D, GLY203C, GLY203D, GLY248C, GLY248D, GLY250C, GLY250D, GLY40C, GLY40D, GLY75C, GLY75D, GLY98C, GLY98D, HIS115C, HIS115D, HIS180C, HIS180D, HIS228C, HIS228D, HIS234C, HIS234D, HIS237C, HIS237D, ILE102C, ILE102D, ILE155C, ILE155D, ILE171C, ILE171D, ILE186C, ILE186D, ILE199C, ILE199D, ILE61C, ILE61D, LEU116C, LEU116D, LEU121C, LEU121D, LEU141C, LEU141D, LEU142C, LEU142D, LEU145C, LEU145D, LEU150C, LEU150D, LEU156C, LEU156D, LEU196C, LEU196D, LEU227C, LEU227D, LEU231C, LEU231D, LEU244C, LEU244D, LEU45C, LEU45D, LEU47C, LEU47D, LEU51C, LEU51D, LEU74C, LEU74D, LEU79C, LEU79D, LYS169C, LYS169D, LYS184C, LYS184D, MET111C, MET111D, MET65C, PHE118C, PHE118D, PHE54C, PHE54D, PRO119C, PRO119D, PRO149C, PRO149D, PRO181C, PRO181D, PRO187C, PRO187D, PRO191C, PRO191D, PRO201C, PRO201D, PRO202C, PRO202D, PRO226C, PRO226D, PRO68C, PRO68D, SER104C, SER104D, SER146C, SER146D, SER178C, SER178D, SER223C, SER223D, SER235C, SER235D, SER241C, SER241D, SER246C, SER246D, SER39C, SER39D, SER42C, SER42D, SER44C, SER44D, SER49C, SER49D, SER50C, SER50D, THR138C, THR138D, THR152C, THR152D, THR174C, THR174D, THR195C, THR195D, THR212C, THR212D, THR225C, THR225D, THR232C, THR232D, THR251C, THR251D, THR46C, THR46D, THR53C, THR53D, THR67C, THR67D, THR69C, THR69D, TRP198C, TRP198D, TRP243C, TRP243D, TYR103C, TYR103D, TYR197C, TYR197D, TYR206C, TYR206D, TYR221C, TYR221D, TYR73C, TYR73D, VAL101C, VAL101D, VAL107C, VAL107D, VAL137C, VAL137D, VAL158C, VAL158D, VAL168C, VAL168D, VAL173C, VAL173D, VAL185C, VAL185D, VAL222C, VAL222D, VAL224C, VAL224D, VAL229C, VAL229D, VAL239C, VAL239D, VAL240C, VAL240D, VAL247C, VAL247D, VAL249C, VAL249D, VAL63C, VAL63D, VAL76C, VAL76D