3NND

the crystal structure of abc transporter from rhodopseudomonas palustris

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 195
  • Norm. En. per Res.: -5.5792
• Hub Node: B(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
B-A	-212.2127	-101.5354	-747.402	-1061.1502	195	51	53	30161	7	40	36
B-C	-34.1603	-84.0103	-177.967	-296.1376	89	28	0	7552	6	65	65
B-D	-8.0985	-34.2278	-115.535	-157.8613	72	16	0	5115	1	19	18
A-C	-16.8364	-28.9745	-131.497	-177.3079	78	13	0	5481	1	19	20
A-D	-44.3393	-98.3523	-169.9	-312.5916	83	16	0	7160	7	64	65
C-D	-234.8099	-98.3789	-754.747	-1087.9359	195	56	54	30296	9	37	31

Interface residues

• B-A: ALA115A, ALA115B, ALA140A, ALA140B, ALA144A, ALA144B, ALA146A, ALA146B, ALA250A, ALA250B, ALA252A, ALA252B, ALA253A, ALA253B, ALA263A, ALA263B, ALA289A, ALA289B, ALA296A, ALA296B, ALA29A, ALA29B, ALA31A, ALA31B, ALA359A, ALA359B, ALA361A, ALA361B, ALA363A, ALA363B, ALA94A, ALA94B, ALA95A, ALA95B, ALA96B, ASN135B, ASN143A, ASN143B, ASN246A, ASN246B, ASN273A, ASN273B, ASN276A, ASN276B, ASP269A, ASP269B, ASP292A, ASP292B, ASP330A, ASP330B, ASP357A, ASP357B, GLN138A, GLN138B, GLN150A, GLN150B, GLN33A, GLN33B, GLN347A, GLN347B, GLN65A, GLN65B, GLU277A, GLU277B, GLU282B, GLU28A, GLU28B, GLU328A, GLU328B, GLU366A, GLU367A, GLY148A, GLY148B, GLY25A, GLY25B, GLY262A, GLY262B, GLY297A, GLY334A, GLY334B, HIS283A, HIS283B, HIS351A, HIS351B, ILE141A, ILE141B, ILE147A, ILE147B, ILE270A, ILE270B, ILE275A, ILE275B, LEU248A, LEU248B, LEU251A, LEU251B, LEU279A, LEU279B, LEU27A, LEU27B, LEU365A, LEU365B, LYS149A, LYS149B, LYS255A, LYS272A, LYS272B, LYS333A, LYS333B, LYS335A, LYS335B, LYS353A, LYS353B, LYS355A, LYS355B, LYS67A, LYS67B, PHE293A, PHE293B, PHE294A, PHE294B, PHE352A, PHE352B, PRO249A, PRO249B, PRO26A, PRO26B, PRO271A, PRO271B, PRO274A, PRO274B, PRO290A, PRO290B, PRO291A, PRO291B, PRO332A, PRO332B, PRO358A, PRO358B, PRO68A, PRO68B, SER136A, SER136B, SER137A, SER137B, SER142A, SER142B, SER348A, SER348B, SER66A, SER66B, SER91A, SER91B, SER92A, SER92B, SER93A, SER93B, THR264A, THR264B, THR281A, THR281B, THR295A, THR295B, TRP278A, TRP278B, TRP362A, TRP362B, TYR254A, TYR254B, TYR265A, TYR265B, TYR266A, TYR266B, TYR267A, TYR267B, TYR268A, TYR268B, TYR30A, TYR30B, TYR350A, TYR350B, VAL145A, VAL145B, VAL280A, VAL280B, VAL337A, VAL337B, VAL354A, VAL354B, VAL356A, VAL356B, VAL360A, VAL360B, VAL364A, VAL364B
• B-C: ALA183B, ALA183C, ALA197B, ALA197C, ALA205B, ALA205C, ALA345B, ALA345C, ARG131B, ARG131C, ARG134B, ARG134C, ARG201B, ARG201C, ARG236B, ARG236C, ARG339B, ARG339C, ASN135B, ASN135C, ASP194C, ASP204B, ASP204C, ASP208B, ASP208C, ASP342B, ASP342C, GLN138B, GLN138C, GLN150C, GLN200B, GLN200C, GLN344B, GLN344C, GLN347B, GLN347C, GLU185B, GLU185C, GLU341B, GLU341C, GLY133B, GLY133C, GLY211B, GLY211C, HIS343B, HIS343C, HIS351B, HIS351C, ILE239B, ILE239C, LEU182B, LEU182C, LEU202B, LEU202C, LEU206B, LEU206C, LEU346B, LEU346C, LYS207B, LYS207C, LYS209B, LYS209C, LYS213C, LYS340B, LYS353B, LYS353C, PHE195B, PHE203B, PHE203C, PHE352B, PHE352C, PRO210B, PRO210C, SER348B, SER348C, THR153B, THR153C, THR181B, THR181C, THR184B, THR184C, THR196B, THR196C, TYR237B, TYR237C, TYR350B, TYR350C, VAL337B, VAL337C
• B-D: ALA263B, ALA263D, ARG236B, ARG236D, ASN246B, ASN246D, ASP204B, ASP204D, ASP231B, ASP231D, ASP233B, ASP233D, ASP269B, ASP269D, GLN200B, GLN200D, GLN230B, GLN230D, GLU240B, GLU261B, GLU261D, GLY244B, GLY244D, GLY245B, GLY245D, GLY259B, GLY262B, GLY262D, ILE247B, ILE247D, ILE270B, LEU226B, LEU226D, LEU229B, LEU229D, LEU241B, LEU241D, LEU248B, LEU248D, LYS207B, LYS207D, LYS228B, LYS228D, LYS235B, LYS235D, PHE195B, PHE203B, PHE203D, PRO225B, PRO234D, PRO290B, PRO290D, SER242B, SER242D, THR196B, THR196D, THR227B, THR227D, THR243B, THR243D, THR264B, THR264D, TYR237B, TYR237D, TYR265B, TYR265D, TYR266B, TYR266D, TYR267B, TYR267D, TYR268B, TYR268D
• A-C: ALA263A, ALA263C, ARG236A, ARG236C, ASN246A, ASN246C, ASP194A, ASP194C, ASP204A, ASP204C, ASP231A, ASP231C, ASP233A, ASP233C, ASP269A, ASP269C, GLN200A, GLN200C, GLN230A, GLN230C, GLU240C, GLU261A, GLU261C, GLY244A, GLY244C, GLY245A, GLY245C, GLY259C, GLY262A, GLY262C, ILE247A, ILE247C, ILE270C, LEU226A, LEU226C, LEU229A, LEU229C, LEU241A, LEU241C, LEU248A, LEU248C, LYS207A, LYS207C, LYS228A, LYS228C, LYS235A, LYS235C, PHE195A, PHE203A, PHE203C, PRO225A, PRO234A, PRO234C, PRO271C, PRO290A, PRO290C, SER136C, SER242A, SER242C, THR193A, THR196A, THR196C, THR227A, THR227C, THR243A, THR243C, THR264A, THR264C, TYR237A, TYR237C, TYR265A, TYR265C, TYR266A, TYR266C, TYR267A, TYR267C, TYR268A, TYR268C
• A-D: ALA183A, ALA183D, ALA197A, ALA205A, ALA205D, ALA345A, ALA345D, ARG131A, ARG131D, ARG134A, ARG134D, ARG201A, ARG201D, ARG236A, ARG236D, ARG339A, ARG339D, ASN135A, ASN135D, ASP194A, ASP204A, ASP204D, ASP208A, ASP208D, ASP342A, ASP342D, GLN150A, GLN200A, GLN200D, GLN344A, GLN344D, GLN347A, GLN347D, GLU341A, GLU341D, GLY133A, GLY133D, GLY211A, GLY211D, HIS343A, HIS343D, HIS351A, HIS351D, ILE239A, ILE239D, LEU182A, LEU182D, LEU202A, LEU202D, LEU206A, LEU206D, LEU346A, LEU346D, LYS207A, LYS207D, LYS209A, LYS209D, LYS213A, LYS213D, LYS353A, LYS353D, PHE203A, PHE203D, PHE352A, PHE352D, PRO210A, PRO210D, SER348A, SER348D, THR153A, THR153D, THR181A, THR181D, THR184A, THR184D, THR196A, THR196D, TYR237A, TYR237D, TYR350A, TYR350D, VAL337A, VAL337D
• C-D: ALA115C, ALA140C, ALA140D, ALA144C, ALA144D, ALA146C, ALA146D, ALA250C, ALA250D, ALA252C, ALA252D, ALA253C, ALA253D, ALA263C, ALA263D, ALA289C, ALA289D, ALA296C, ALA296D, ALA29C, ALA29D, ALA31C, ALA359C, ALA359D, ALA361C, ALA361D, ALA363C, ALA363D, ALA94C, ALA94D, ALA95C, ALA95D, ASN135C, ASN135D, ASN143C, ASN143D, ASN246C, ASN246D, ASN273C, ASN273D, ASN276C, ASN276D, ASP139C, ASP139D, ASP269C, ASP269D, ASP292C, ASP292D, ASP330C, ASP330D, ASP357C, ASP357D, GLN138C, GLN138D, GLN150C, GLN150D, GLN33C, GLN33D, GLN347C, GLN347D, GLN65C, GLN65D, GLU277C, GLU277D, GLU282D, GLU28C, GLU28D, GLU328C, GLU328D, GLY148C, GLY148D, GLY25C, GLY25D, GLY262C, GLY262D, GLY297C, GLY297D, GLY334C, GLY334D, HIS283C, HIS283D, HIS351C, HIS351D, ILE141C, ILE141D, ILE147C, ILE147D, ILE270C, ILE270D, ILE275C, ILE275D, LEU248C, LEU248D, LEU251C, LEU251D, LEU279C, LEU279D, LEU27C, LEU27D, LEU365C, LEU365D, LYS149C, LYS149D, LYS255D, LYS272C, LYS272D, LYS333C, LYS333D, LYS335C, LYS335D, LYS353C, LYS353D, LYS355C, LYS355D, LYS67C, LYS67D, PHE293C, PHE293D, PHE294C, PHE294D, PHE299C, PHE352C, PHE352D, PRO249C, PRO249D, PRO26C, PRO26D, PRO271C, PRO271D, PRO274C, PRO274D, PRO290C, PRO290D, PRO291C, PRO291D, PRO332C, PRO332D, PRO358C, PRO358D, PRO68C, PRO68D, SER136C, SER136D, SER137C, SER137D, SER142C, SER142D, SER348C, SER348D, SER66C, SER66D, SER91C, SER91D, SER92C, SER92D, SER93C, SER93D, THR264C, THR264D, THR281C, THR281D, THR295C, THR295D, TRP278C, TRP278D, TRP362C, TRP362D, TYR254C, TYR254D, TYR265C, TYR265D, TYR266C, TYR266D, TYR267C, TYR267D, TYR268C, TYR268D, TYR30C, TYR30D, TYR350C, TYR350D, VAL145C, VAL145D, VAL280C, VAL280D, VAL337C, VAL337D, VAL354C, VAL354D, VAL356C, VAL356D, VAL360C, VAL360D, VAL364C, VAL364D