3QJH

the crystal structure of the 5c.c7 tcr

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 91
  • Norm. En. per Res.: -2.5825
• 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	-94.8497	-8.0331	180.173	77.2901	210	25	13	21568	6	45	39
A-C	-44.734	-12.5312	-177.742	-235.0072	91	14	1	7870	0	15	23
A-D	-3.1423	0.0	-26.8909	-30.0332	32	1	0	1508	0	5	7
B-C	0.0	0.0	-27.3731	-27.3731	38	6	0	1493	0	5	8
C-D	-100.1384	-3.1248	121.831	18.5678	212	22	13	21732	6	44	38

Interface residues

• A-B: ALA124A, ALA129B, ALA136B, ALA144B, ALA150B, ALA178A, ALA180A, ALA185B, ALA192B, ALA201B, ALA240B, ALA242B, ALA30A, ALA49A, ALA91A, ALA93B, ALA94A, ALA99B, ARG110B, ARG111A, ARG129A, ARG169A, ARG190B, ARG196B, ARG198B, ARG212B, ARG245B, ARG29A, ARG39A, ARG9B, ASN100B, ASN176A, ASN183A, ASN37A, ASN38B, ASN40B, ASN41B, ASN44A, ASN98A, ASN98B, ASP102B, ASP122A, ASP130A, ASP135A, ASP143A, ASP155A, ASP157A, ASP162A, ASP167A, ASP172A, ASP176B, ASP1A, ASP201A, CYS139A, CYS148B, CYS164A, CYS174B, CYS213B, CYS90A, CYS92B, GLN127A, GLN142B, GLN152A, GLN178B, GLN183B, GLN2A, GLN32A, GLN37B, GLN56B, GLN57B, GLN6B, GLU132B, GLU135B, GLU137B, GLU159B, GLU182B, GLU241B, GLU42B, GLU93A, GLY106B, GLY107A, GLY108B, GLY109A, GLY152B, GLY172B, GLY40A, HIS140B, HIS170B, HIS210B, ILE118A, ILE138B, ILE160A, ILE43A, ILE58B, LEU128A, LEU140A, LEU146B, LEU149B, LEU166A, LEU180B, LEU193B, LEU197B, LEU42A, LEU45A, LEU48A, LEU82A, LEU89B, LEU91B, LYS132A, LYS136A, LYS143B, LYS154A, LYS163A, LYS174A, LYS181B, LYS36A, LYS3B, LYS44B, LYS53A, LYS99A, MET168A, MET171A, MET2B, PHE105B, PHE106A, PHE131B, PHE141A, PHE144A, PHE173A, PHE193A, PHE203A, PHE203B, PHE204A, PHE211B, PHE33B, PHE34A, PHE43B, PHE45B, PHE46A, PHE89A, PRO121A, PRO123A, PRO133B, PRO177B, PRO179B, PRO184B, PRO205A, SER101B, SER107B, SER131A, SER134B, SER137A, SER139B, SER153A, SER156A, SER170A, SER171B, SER175A, SER177A, SER182A, SER189B, SER194B, SER195B, SER200B, SER206A, SER239B, SER41A, SER94B, SER95B, THR104B, THR108A, THR110A, THR141B, THR142A, THR145B, THR151B, THR161A, THR175B, THR202A, THR87A, THR97A, TRP181A, TRP204B, TRP243B, TRP33A, TYR103B, TYR10B, TYR126A, TYR159A, TYR191B, TYR35B, TYR47A, TYR88A, VAL104A, VAL105A, VAL125A, VAL128B, VAL130B, VAL138A, VAL147B, VAL150A, VAL158A, VAL158B, VAL165A, VAL169B, VAL173B, VAL179A, VAL199B, VAL31A, VAL4B
• A-C: ALA19A, ALA19C, ALA9A, ALA9C, ARG111A, ARG111C, ARG21A, ARG21C, ASN117A, ASN117C, ASN149A, ASN195A, ASN23A, ASN23C, ASP155A, ASP155C, ASP157A, ASP157C, ASP79C, CYS22A, GLN113A, GLN113C, GLN147A, GLN147C, GLN152A, GLN152C, GLN2A, GLN2C, GLN5A, GLN5C, GLU14A, GLU14C, GLU4A, GLU4C, GLY109A, GLY109C, GLY15A, GLY15C, GLY17A, GLY17C, HIS13A, HIS13C, HIS72A, HIS72C, ILE160A, ILE160C, LEU10A, LEU10C, LEU112A, LEU112C, LEU115A, LEU115C, LEU12A, LEU12C, LEU20A, LEU20C, LYS154A, LYS154C, LYS163A, PRO7A, PRO7C, SER11A, SER11C, SER146A, SER146C, SER151A, SER151C, SER153A, SER153C, SER156A, SER156C, SER18A, SER18C, SER6A, SER6C, SER8A, SER8C, THR108A, THR108C, THR110A, THR110C, THR16A, THR16C, TRP181C, TYR159A, TYR159C, VAL114A, VAL114C, VAL150A, VAL158A, VAL158C
• A-D: ALA185D, ALA192A, ASN149A, ASN187D, ASN191A, ASN194A, ASN195A, ASN38D, ASN40D, ASN41D, ASP145A, ASP155A, GLN147A, GLN152A, GLN183D, GLU182D, GLU42D, ILE197A, LEU180D, LEU186D, LYS154A, LYS181D, LYS39D, PHE193A, PRO184D, PRO199A, SER151A, SER153A, SER189D, SER196A, THR148A, VAL158A
• B-C: ALA185B, ALA192C, ALA84B, ASN149C, ASN187B, ASN191C, ASN194C, ASN195C, ASN38B, ASN40B, ASN41B, ASP145C, ASP155C, GLN147C, GLN152C, GLN178B, GLN183B, GLU182B, GLU200C, GLU42B, GLY85B, ILE160C, ILE197C, LEU180B, LEU186B, LYS154C, LYS181B, LYS184C, LYS39B, PHE193C, PRO184B, PRO199C, SER151C, SER153C, SER196C, SER87B, THR148C, TYR191B
• C-D: ALA124C, ALA129D, ALA136D, ALA144D, ALA150D, ALA178C, ALA180C, ALA185D, ALA192D, ALA201D, ALA240D, ALA242D, ALA30C, ALA49C, ALA91C, ALA93D, ALA99D, ARG110D, ARG111C, ARG129C, ARG169C, ARG190D, ARG196D, ARG198D, ARG245D, ARG29C, ARG39C, ARG9D, ASN100D, ASN176C, ASN183C, ASN37C, ASN38D, ASN40D, ASN41D, ASN44C, ASN48D, ASN97D, ASN98C, ASN98D, ASP102D, ASP122C, ASP130C, ASP135C, ASP143C, ASP155C, ASP156D, ASP157C, ASP162C, ASP167C, ASP172C, ASP176D, ASP1C, ASP201C, CYS139C, CYS148D, CYS164C, CYS174D, CYS90C, CYS92D, GLN113C, GLN127C, GLN142D, GLN152C, GLN178D, GLN183D, GLN2C, GLN32C, GLN37D, GLN56D, GLN6D, GLU127D, GLU132D, GLU135D, GLU137D, GLU159D, GLU182D, GLU241D, GLU26D, GLU42D, GLU93C, GLY106D, GLY107C, GLY108D, GLY109C, GLY152D, GLY172D, GLY40C, HIS140D, HIS170D, HIS29D, ILE118C, ILE138D, ILE160C, ILE43C, LEU128C, LEU140C, LEU146D, LEU149D, LEU166C, LEU180D, LEU186D, LEU193D, LEU197D, LEU42C, LEU45C, LEU48C, LEU82C, LEU89D, LEU91D, LYS132C, LYS136C, LYS143D, LYS163C, LYS174C, LYS181D, LYS36C, LYS3D, LYS44D, LYS53C, LYS99C, MET168C, MET171C, MET2D, PHE105D, PHE106C, PHE131D, PHE141C, PHE144C, PHE173C, PHE193C, PHE203C, PHE203D, PHE204C, PHE211D, PHE33D, PHE34C, PHE43D, PHE45D, PHE46C, PHE89C, PRO121C, PRO123C, PRO133D, PRO177D, PRO179D, PRO184D, PRO205C, SER101D, SER107D, SER131C, SER134D, SER137C, SER139D, SER153C, SER156C, SER170C, SER171D, SER175C, SER177C, SER182C, SER189D, SER194D, SER195D, SER200D, SER206C, SER239D, SER41C, SER94D, SER95D, THR104D, THR108C, THR110C, THR141D, THR142C, THR145D, THR151D, THR161C, THR175D, THR202C, THR87C, THR97C, TRP181C, TRP204D, TRP243D, TRP33C, TYR103D, TYR10D, TYR126C, TYR159C, TYR191D, TYR35D, TYR47C, TYR88C, VAL104C, VAL105C, VAL125C, VAL128D, VAL130D, VAL138C, VAL147D, VAL150C, VAL158C, VAL158D, VAL165C, VAL169D, VAL173D, VAL179C, VAL199D, VAL238D, VAL31C, VAL4D