3A74

lysyl-trna synthetase from bacillus stearothermophilus complexed with diadenosine tetraphosphate (ap4a)

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 374
  • Norm. En. per Res.: -4.9075
• 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	-313.9174	-279.1808	-1218.9	-1811.9982	374	57	28	47938	26	191	158
A-C	-11.2876	1.8984	-30.7043	-40.0935	56	4	0	1622	0	37	32
A-D	-11.0768	-4.1961	-67.0436	-82.3165	52	1	2	3008	1	25	22
B-C	0.0	12.119	-10.5238	1.5952	11	0	0	452	0	3	4
C-D	-329.8558	-279.5998	-1225.96	-1835.4156	374	55	27	47963	26	189	159

Interface residues

• A-B: ALA139A, ALA139B, ALA203A, ALA203B, ALA219A, ALA219B, ALA273A, ALA273B, ALA275A, ALA275B, ALA37A, ALA37B, ALA453A, ALA453B, ALA62A, ALA62B, ARG12A, ARG12B, ARG13A, ARG13B, ARG141A, ARG141B, ARG158A, ARG158B, ARG160A, ARG160B, ARG177A, ARG177B, ARG185A, ARG185B, ARG186A, ARG186B, ARG211A, ARG211B, ARG227A, ARG227B, ARG236A, ARG236B, ARG250A, ARG250B, ARG253A, ARG253B, ARG278A, ARG278B, ARG30A, ARG30B, ARG33A, ARG33B, ARG426A, ARG426B, ARG482B, ARG491A, ARG491B, ARG64A, ARG64B, ASN218A, ASN218B, ASN254A, ASN254B, ASN262A, ASN262B, ASN393A, ASN393B, ASN420A, ASN420B, ASP110A, ASP110B, ASP163A, ASP163B, ASP189A, ASP189B, ASP221A, ASP221B, ASP25A, ASP25B, ASP276A, ASP276B, ASP279A, ASP279B, ASP395A, ASP395B, ASP401A, ASP401B, ASP421A, ASP421B, ASP424A, ASP424B, ASP449A, ASP449B, ASP469A, ASP469B, ASP81A, ASP81B, GLN155A, GLN155B, GLN159A, GLN159B, GLN182A, GLN182B, GLN489A, GLN489B, GLN80A, GLN80B, GLU134A, GLU134B, GLU145A, GLU195A, GLU195B, GLU197A, GLU197B, GLU20A, GLU20B, GLU243A, GLU243B, GLU247A, GLU247B, GLU255A, GLU255B, GLU264A, GLU264B, GLU272A, GLU272B, GLU32A, GLU32B, GLU418A, GLU418B, GLU448A, GLU448B, GLU452A, GLU452B, GLU455A, GLU455B, GLY109A, GLY109B, GLY113A, GLY113B, GLY192A, GLY192B, GLY240A, GLY240B, GLY241A, GLY241B, GLY249A, GLY249B, GLY256A, GLY256B, GLY28A, GLY28B, GLY457A, GLY457B, GLY462B, GLY63A, GLY63B, GLY84A, GLY84B, HIS191A, HIS191B, HIS202A, HIS202B, HIS216A, HIS216B, HIS217A, HIS217B, HIS233A, HIS233B, HIS261A, HIS35B, HIS492A, HIS492B, ILE111A, ILE111B, ILE165A, ILE165B, ILE175A, ILE175B, ILE181A, ILE181B, ILE214A, ILE214B, ILE230A, ILE230B, ILE238A, ILE238B, ILE248A, ILE248B, ILE257A, ILE257B, ILE280A, ILE280B, ILE423A, ILE423B, ILE79B, LEU108A, LEU108B, LEU136A, LEU136B, LEU140A, LEU140B, LEU143A, LEU143B, LEU162A, LEU162B, LEU164A, LEU164B, LEU16A, LEU16B, LEU179A, LEU179B, LEU188B, LEU194A, LEU194B, LEU220A, LEU220B, LEU224A, LEU224B, LEU232A, LEU232B, LEU234A, LEU234B, LEU237A, LEU237B, LEU242A, LEU242B, LEU419A, LEU419B, LEU451A, LEU451B, LEU454A, LEU454B, LEU485A, LEU485B, LEU486A, LEU486B, LEU5B, LEU9A, LEU9B, LYS138A, LYS138B, LYS171A, LYS171B, LYS172A, LYS172B, LYS17A, LYS17B, LYS235A, LYS235B, LYS244A, LYS244B, LYS282A, LYS282B, LYS29A, LYS29B, LYS36A, LYS36B, LYS391A, LYS391B, LYS392A, LYS392B, MET166A, MET166B, MET200A, MET200B, MET201A, MET201B, MET222A, MET222B, MET226A, MET226B, MET267A, MET267B, MET458A, MET458B, MET490A, MET490B, PHE135A, PHE135B, PHE174A, PHE174B, PHE213A, PHE213B, PHE252A, PHE252B, PHE265A, PHE265B, PHE277A, PHE277B, PHE27A, PHE27B, PHE31A, PHE31B, PHE450A, PHE450B, PHE487A, PHE487B, PRO142A, PRO142B, PRO144A, PRO144B, PRO168A, PRO199A, PRO199B, PRO212A, PRO212B, PRO263A, PRO263B, PRO26A, PRO26B, PRO394A, PRO394B, PRO422A, PRO422B, PRO459A, PRO459B, PRO460A, PRO460B, PRO488A, PRO488B, SER170A, SER170B, SER178A, SER178B, SER190A, THR137A, THR137B, THR173A, THR173B, THR176A, THR176B, THR198A, THR198B, THR215A, THR215B, THR223A, THR223B, THR266A, THR266B, THR417A, THR417B, THR461A, THR461B, THR83A, THR83B, TYR161A, TYR161B, TYR193A, TYR193B, TYR225A, TYR225B, TYR246A, TYR246B, TYR274A, TYR274B, TYR456A, TYR456B, VAL112A, VAL112B, VAL196A, VAL196B, VAL239A, VAL239B, VAL245A, VAL245B, VAL251A, VAL251B, VAL468A, VAL468B, VAL472A, VAL472B, VAL484A, VAL484B, VAL61A, VAL61B, VAL82A, VAL82B
• A-C: ALA344A, ARG115C, ARG211A, ARG260A, ARG30C, ARG33C, ARG482A, ARG491A, ARG91C, ASP152A, ASP371A, ASP93C, ASP94C, GLN367A, GLN55C, GLN56C, GLN92C, GLN98C, GLN99C, GLU154A, GLU305A, GLU32C, GLU346A, GLU350A, GLU39C, GLU51C, GLU54C, GLU58C, GLU97C, GLY256A, GLY348A, GLY96C, HIS347A, HIS35C, HIS492A, ILE153A, ILE257A, ILE57C, LEU43C, LEU47C, LEU52C, LYS129C, LYS29C, LYS345A, LYS368A, LYS372A, LYS73C, PRO479A, SER258A, THR117C, THR259A, THR34C, TYR44C, VAL349A, VAL59C, VAL95C
• A-D: ALA77A, ARG69A, ASN477D, ASP309D, ASP46D, GLN302D, GLN85A, GLN87A, GLN92A, GLU125A, GLU145A, GLU169A, GLU294D, GLU313D, GLU42D, GLY124A, GLY297D, GLY45A, GLY45D, GLY72A, HIS191D, HIS290D, HIS306D, HIS78A, ILE301D, LEU126A, LEU296D, LEU307D, LYS120A, LYS122A, LYS146A, LYS300D, LYS49A, LYS68A, LYS73A, MET66A, PHE41A, PHE41D, PHE76A, SER127A, SER190D, SER48A, THR121A, THR293D, THR298D, THR299D, THR67A, TYR187D, TYR303D, VAL123A, VAL295D, VAL308D
• B-C: ALA219B, ASN218B, ASP221B, GLN55C, GLN56C, GLU51C, GLU53C, GLU54C, HIS216B, HIS217B, LEU220B
• C-D: ALA139C, ALA139D, ALA203C, ALA203D, ALA219C, ALA219D, ALA273C, ALA273D, ALA275C, ALA275D, ALA37C, ALA37D, ALA453C, ALA453D, ALA62C, ALA62D, ARG12C, ARG12D, ARG13C, ARG13D, ARG141C, ARG141D, ARG158C, ARG158D, ARG160C, ARG160D, ARG177C, ARG177D, ARG185C, ARG185D, ARG186C, ARG186D, ARG211C, ARG211D, ARG227C, ARG227D, ARG236C, ARG236D, ARG250C, ARG250D, ARG253C, ARG253D, ARG278C, ARG278D, ARG30C, ARG30D, ARG33C, ARG33D, ARG426C, ARG426D, ARG482D, ARG491C, ARG491D, ARG64C, ARG64D, ASN218C, ASN218D, ASN254C, ASN254D, ASN262C, ASN262D, ASN393C, ASN393D, ASN420C, ASN420D, ASP110C, ASP110D, ASP163C, ASP163D, ASP189C, ASP189D, ASP221C, ASP221D, ASP25C, ASP25D, ASP276C, ASP276D, ASP279C, ASP279D, ASP395C, ASP395D, ASP401C, ASP401D, ASP421C, ASP421D, ASP424C, ASP424D, ASP449C, ASP449D, ASP469C, ASP469D, ASP81C, ASP81D, GLN155C, GLN155D, GLN159C, GLN159D, GLN182C, GLN182D, GLN489C, GLN489D, GLN80C, GLN80D, GLU134C, GLU134D, GLU145C, GLU195C, GLU195D, GLU197C, GLU197D, GLU20C, GLU20D, GLU243C, GLU243D, GLU247C, GLU247D, GLU255C, GLU255D, GLU264C, GLU264D, GLU272C, GLU272D, GLU32C, GLU32D, GLU418C, GLU418D, GLU448C, GLU448D, GLU452C, GLU452D, GLU455C, GLU455D, GLY109C, GLY109D, GLY113C, GLY113D, GLY192C, GLY192D, GLY240C, GLY240D, GLY241C, GLY241D, GLY249C, GLY249D, GLY256C, GLY256D, GLY28C, GLY28D, GLY457C, GLY457D, GLY462D, GLY63C, GLY63D, GLY84C, GLY84D, HIS191C, HIS191D, HIS202C, HIS202D, HIS216C, HIS216D, HIS217C, HIS217D, HIS233C, HIS233D, HIS261C, HIS35D, HIS492C, HIS492D, ILE111C, ILE111D, ILE165C, ILE165D, ILE175C, ILE175D, ILE181C, ILE181D, ILE214C, ILE214D, ILE230C, ILE230D, ILE238C, ILE238D, ILE248C, ILE248D, ILE257C, ILE257D, ILE280C, ILE280D, ILE423C, ILE423D, ILE79C, LEU108C, LEU108D, LEU136C, LEU136D, LEU140C, LEU140D, LEU143C, LEU143D, LEU162C, LEU162D, LEU164C, LEU164D, LEU16C, LEU16D, LEU179C, LEU179D, LEU188D, LEU194C, LEU194D, LEU220C, LEU220D, LEU224C, LEU224D, LEU232C, LEU232D, LEU234C, LEU234D, LEU237C, LEU237D, LEU242C, LEU242D, LEU419C, LEU419D, LEU451C, LEU451D, LEU454C, LEU454D, LEU485C, LEU485D, LEU486C, LEU486D, LEU5D, LEU9C, LEU9D, LYS138C, LYS138D, LYS171C, LYS171D, LYS172C, LYS172D, LYS17C, LYS17D, LYS235C, LYS235D, LYS244C, LYS244D, LYS282C, LYS282D, LYS29C, LYS29D, LYS36C, LYS36D, LYS391C, LYS391D, LYS392C, LYS392D, MET166C, MET166D, MET200C, MET200D, MET201C, MET201D, MET222C, MET222D, MET226C, MET226D, MET267C, MET267D, MET458C, MET458D, MET490C, MET490D, PHE135C, PHE135D, PHE174C, PHE174D, PHE213C, PHE213D, PHE252C, PHE252D, PHE265C, PHE265D, PHE277C, PHE277D, PHE27C, PHE27D, PHE31C, PHE31D, PHE450C, PHE450D, PHE487C, PHE487D, PRO142C, PRO142D, PRO144C, PRO144D, PRO168C, PRO199C, PRO199D, PRO212C, PRO212D, PRO263C, PRO263D, PRO26C, PRO26D, PRO394C, PRO394D, PRO422C, PRO422D, PRO459C, PRO459D, PRO460C, PRO460D, PRO488C, PRO488D, SER170C, SER170D, SER178C, SER178D, SER190C, THR137C, THR137D, THR173C, THR173D, THR176C, THR176D, THR198C, THR198D, THR215C, THR215D, THR223C, THR223D, THR266C, THR266D, THR417C, THR417D, THR461C, THR461D, THR83C, THR83D, TYR161C, TYR161D, TYR193C, TYR193D, TYR225C, TYR225D, TYR246C, TYR246D, TYR274C, TYR274D, TYR456C, TYR456D, VAL112C, VAL112D, VAL196C, VAL196D, VAL239C, VAL239D, VAL245C, VAL245D, VAL251C, VAL251D, VAL468C, VAL468D, VAL472C, VAL472D, VAL484C, VAL484D, VAL61C, VAL61D, VAL82C, VAL82D