3KT8

crystal structure of s. cerevisiae tryptophanyl-trna synthetase in complex with l-tryptophanamide

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 132
  • Norm. En. per Res.: -4.7459
• 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	-125.0331	-17.3367	-484.088	-626.4577	132	21	14	17928	6	43	53
A-C	-18.1952	-48.8089	-77.98	-144.984	46	7	2	3433	2	22	21
A-D	-41.6811	-40.1662	-243.757	-325.6043	145	8	3	11281	8	48	58
B-D	-18.7707	-45.7065	-80.6693	-145.1465	47	3	2	3495	1	21	23
C-D	-127.6833	-22.6607	-477.902	-628.246	133	18	13	17798	5	45	52

Interface residues

• A-B: ALA192A, ALA192B, ALA209A, ALA209B, ALA211B, ALA227A, ALA227B, ARG199A, ARG199B, ARG202A, ARG202B, ASN157A, ASN157B, ASN216A, ASN216B, ASP144A, ASP144B, ASP145A, ASP145B, ASP158A, ASP158B, ASP185A, ASP185B, ASP217A, ASP217B, ASP219A, ASP219B, CYS220A, CYS220B, GLN187A, GLN187B, GLN203A, GLN203B, GLU146A, GLU146B, GLU195A, GLU195B, GLY190A, GLY190B, GLY191A, GLY191B, GLY206A, GLY206B, GLY222A, GLY222B, HIS152A, HIS152B, HIS225A, HIS225B, ILE156A, ILE156B, ILE204A, ILE204B, ILE221A, ILE221B, ILE229A, ILE229B, ILE231A, ILE231B, LEU149A, LEU149B, LEU154A, LEU154B, LEU186A, LEU186B, LEU273A, LEU273B, LYS147A, LYS147B, LYS151A, LYS151B, LYS153A, LYS153B, LYS160A, LYS160B, LYS210A, LYS210B, LYS223A, LYS223B, LYS272A, MET189A, MET189B, PHE148A, PHE148B, PHE150A, PHE150B, PHE193A, PHE193B, PHE213A, PHE213B, PHE215A, PHE215B, PHE224A, PHE224B, PHE226A, PHE226B, SER184A, SER184B, SER201A, SER201B, SER207A, SER207B, SER218A, SER218B, SER228A, SER228B, THR155A, THR155B, THR196A, THR196B, THR205A, THR205B, THR208A, THR208B, TYR188A, TYR188B, TYR194A, TYR194B, TYR275A, TYR275B, VAL159A, VAL159B, VAL197A, VAL197B, VAL198A, VAL198B, VAL200A, VAL200B, VAL265A, VAL265B, VAL269A, VAL269B
• A-C: ALA209C, ALA211C, ALA270C, ALA330A, ARG264C, ARG267C, ARG334A, ARG88C, ASN339A, ASP217C, ASP260C, ASP268C, ASP271C, ASP331A, CYS266C, GLN203C, GLN327A, GLN39A, GLN53C, GLU335A, GLY326A, GLY40A, GLY55C, HIS333A, ILE204C, LEU273C, LEU332A, LEU336A, LYS210C, LYS272C, LYS277C, PHE213C, PHE263C, PHE323A, PHE54C, PRO261C, SER207C, SER324A, SER329A, THR205C, THR208C, VAL212C, VAL265C, VAL269C, VAL328A, VAL342A
• A-D: 2117CB8.6324, ALA209A, ALA209D, ALA211A, ALA211D, ALA42A, ALA42D, ARG264A, ARG264D, ARG267A, ARG41A, ARG41D, ARG88A, ARG88D, ASN216A, ASN216D, ASN339A, ASN339D, ASN44A, ASN44D, ASP217A, ASP217D, ASP219A, ASP219D, ASP21A, ASP21D, ASP260A, ASP260D, ASP268A, ASP268D, ASP300D, ASP31A, ASP31D, ASP37A, ASP37D, CYS220A, CYS220D, CYS266A, GLN203A, GLN25A, GLN25D, GLN290A, GLN290D, GLN39A, GLN39D, GLN43A, GLN43D, GLN53A, GLN53D, GLU16D, GLU24A, GLU24D, GLU33A, GLU33D, GLU38A, GLU38D, GLY206A, GLY206D, GLY214A, GLY214D, GLY325A, GLY40A, GLY40D, GLY55A, GLY55D, HIS152A, HIS152D, ILE204A, ILE231A, LEU17D, LEU50A, LEU50D, LYS153A, LYS153D, LYS18A, LYS18A5, LYS18D, LYS210A, LYS210D, LYS223A, LYS223D, LYS23A, LYS23D, LYS272A, LYS277A, LYS295A, LYS320A, LYS320D, LYS49A, LYS52A, LYS52D, PHE150A, PHE150D, PHE213A, PHE213D, PHE215A, PHE215D, PHE224A, PHE224D, PHE263A, PHE323A, PHE323D, PHE54A, PHE54D, PRO261A, PRO261D, PRO29A, PRO29D, SER19A, SER19D, SER207A, SER207D, SER218A, SER218D, SER292A, SER324A, THR205A, THR208A, THR208D, THR20A, THR20D, THR28A, THR28D, THR302A, THR302D, THR56D, TRP30A, TRP30D, TYR321A, TYR321D, VAL212A, VAL212D, VAL22A, VAL22D, VAL265A, VAL265D, VAL269A, VAL26A, VAL26D, VAL27A, VAL27D, VAL342A, VAL342D, VAL36A, VAL36D
• B-D: ALA209B, ALA211B, ALA270B, ALA330D, ARG264B, ARG267B, ARG334D, ARG88B, ASN339D, ASP217B, ASP260B, ASP268B, ASP271B, ASP331D, CYS266B, GLN203B, GLN327D, GLN39D, GLN53B, GLU16D, GLU335D, GLY326D, GLY55B, HIS333D, ILE204B, LEU273B, LEU332D, LEU336D, LYS210B, LYS272B, LYS277B, PHE213B, PHE263B, PHE323D, PHE54B, PRO261B, SER207B, SER218B, SER324D, SER329D, THR205B, THR208B, THR56B, VAL212B, VAL265B, VAL269B, VAL328D
• C-D: ALA192C, ALA192D, ALA209C, ALA209D, ALA211C, ALA227C, ALA227D, ARG199C, ARG199D, ARG202C, ARG202D, ASN157C, ASN157D, ASN216C, ASN216D, ASP144C, ASP144D, ASP145C, ASP145D, ASP158C, ASP158D, ASP185C, ASP185D, ASP217C, ASP217D, ASP219C, ASP219D, CYS220C, CYS220D, GLN187C, GLN187D, GLN203C, GLN203D, GLU146C, GLU146D, GLU195C, GLU195D, GLY190C, GLY190D, GLY191C, GLY191D, GLY206C, GLY206D, GLY222C, GLY222D, HIS152C, HIS152D, HIS225C, HIS225D, ILE156C, ILE156D, ILE204C, ILE204D, ILE221C, ILE221D, ILE229C, ILE229D, ILE231C, ILE231D, LEU149C, LEU149D, LEU154C, LEU154D, LEU186C, LEU186D, LEU273C, LEU273D, LYS147C, LYS147D, LYS151C, LYS151D, LYS153C, LYS153D, LYS160C, LYS160D, LYS210C, LYS210D, LYS223C, LYS223D, LYS274C, MET189C, MET189D, PHE148C, PHE148D, PHE150C, PHE150D, PHE193C, PHE193D, PHE213C, PHE213D, PHE215C, PHE215D, PHE224C, PHE224D, PHE226C, PHE226D, SER184C, SER184D, SER201C, SER201D, SER207C, SER207D, SER218C, SER218D, SER228C, SER228D, THR143D, THR155C, THR155D, THR196C, THR196D, THR205C, THR205D, THR208C, THR208D, TYR188C, TYR188D, TYR194C, TYR194D, TYR275C, TYR275D, VAL159C, VAL159D, VAL197C, VAL197D, VAL198C, VAL198D, VAL200C, VAL200D, VAL265C, VAL265D, VAL269C, VAL269D