2QZV

draft crystal structure of the vault shell at 9 angstroms resolution

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 605
  • Norm. En. per Res.: -0.608
• Hub Node: A(1)

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	-13.7006	0.0	-354.164	-367.8646	605	32	40	23242	0	313	313

Interface residues

• A-B: ALA120A, ALA125B, ALA139B, ALA165A, ALA178A, ALA178B, ALA203A, ALA207A, ALA218A, ALA231B, ALA258A, ALA336A, ALA353A, ALA353B, ALA369A, ALA400B, ALA435A, ALA435B, ALA443B, ALA450B, ALA467A, ALA475B, ALA502B, ALA532B, ALA571A, ALA574A, ALA576A, ALA582A, ALA584A, ALA596A, ALA602A, ALA622B, ALA626B, ALA62B, ALA653B, ALA661B, ALA671A, ALA672A, ALA673B, ALA677B, ALA684B, ALA699A, ALA702A, ALA702B, ALA711A, ALA711B, ALA715A, ALA715B, ALA722A, ALA722B, ALA724A, ALA724B, ALA730A, ALA730B, ALA732A, ALA732B, ALA733A, ALA733B, ALA744A, ALA744B, ALA86A, ALA86B, ALA93A, ARG175A, ARG177A, ARG177B, ARG179A, ARG179B, ARG185B, ARG190B, ARG199A, ARG230B, ARG239A, ARG27A, ARG315B, ARG318B, ARG360A, ARG399B, ARG42A, ARG42B, ARG437A, ARG437B, ARG452B, ARG474B, ARG477B, ARG504B, ARG507B, ARG511B, ARG552B, ARG56B, ARG578A, ARG580A, ARG600B, ARG623B, ARG649A, ARG649B, ARG651A, ARG651B, ARG656A, ARG656B, ARG679A, ARG679B, ARG685B, ARG687B, ARG690A, ARG690B, ARG703A, ARG729A, ARG729B, ARG734A, ARG734B, ARG82B, ARG84B, ARG91A, ASN118A, ASN133A, ASN171A, ASN385A, ASN428B, ASN453B, ASN544B, ASN551B, ASN553B, ASN594B, ASN631B, ASN63B, ASN667B, ASN721A, ASN721B, ASP141B, ASP184B, ASP214B, ASP237A, ASP255A, ASP355A, ASP355B, ASP383A, ASP39B, ASP411A, ASP432B, ASP436A, ASP436B, ASP490A, ASP525A, ASP554B, ASP566A, ASP570A, ASP611A, ASP611B, ASP615B, ASP624B, ASP639B, ASP647A, ASP647B, ASP652A, ASP695A, ASP76B, ASP87A, ASP87B, ASP95A, CYS182B, CYS356A, CYS356B, CYS515B, CYS572A, CYS59B, GLN113A, GLN154B, GLN170A, GLN233B, GLN254A, GLN321B, GLN329A, GLN330A, GLN338B, GLN352A, GLN352B, GLN384A, GLN38B, GLN439A, GLN447B, GLN469A, GLN494A, GLN538B, GLN625B, GLN630B, GLN641B, GLN648A, GLN655A, GLN659A, GLN669A, GLN678A, GLN678B, GLN682A, GLN682B, GLN691A, GLN691B, GLN696A, GLN80B, GLN88A, GLN88B, GLN94A, GLU142B, GLU146A, GLU156B, GLU158B, GLU161B, GLU181B, GLU186B, GLU194A, GLU194B, GLU195A, GLU195B, GLU210B, GLU211A, GLU223A, GLU247B, GLU248B, GLU257A, GLU265B, GLU266B, GLU29A, GLU314B, GLU317B, GLU341B, GLU342B, GLU364A, GLU412A, GLU416A, GLU418A, GLU41B, GLU424A, GLU485A, GLU492A, GLU493A, GLU530A, GLU548B, GLU607A, GLU610A, GLU610B, GLU644B, GLU663A, GLU663B, GLU670A, GLU676A, GLU676B, GLU681B, GLU683A, GLU683B, GLU689B, GLU698B, GLU700A, GLU700B, GLU705B, GLU708B, GLU710A, GLU717A, GLU717B, GLU725A, GLU725B, GLU731A, GLU731B, GLU736A, GLU736B, GLU738A, GLU738B, GLU89A, GLU89B, GLY140B, GLY147A, GLY149A, GLY187B, GLY189B, GLY193B, GLY202A, GLY240A, GLY246B, GLY269B, GLY313B, GLY319B, GLY31A, GLY354A, GLY354B, GLY361A, GLY396B, GLY422A, GLY430B, GLY438A, GLY441B, GLY503B, GLY569A, GLY581A, GLY605A, GLY613B, GLY616B, GLY632B, GLY686A, GLY686B, GLY720A, GLY720B, GLY737A, GLY737B, GLY739A, GLY739B, GLY79B, HIS122B, HIS228B, HIS351A, HIS351B, HIS431B, HIS546B, HIS592A, HIS675A, HIS85A, HIS85B, ILE152B, ILE168A, ILE220A, ILE320B, ILE359A, ILE527A, ILE575A, ILE598B, ILE599B, ILE60B, ILE662A, ILE664B, ILE693A, ILE735A, ILE735B, ILE77B, ILE90A, LEU116A, LEU126B, LEU127B, LEU144A, LEU174A, LEU176A, LEU176B, LEU197A, LEU205A, LEU213B, LEU221A, LEU229B, LEU232B, LEU238A, LEU268B, LEU310A, LEU316B, LEU332A, LEU332B, LEU333A, LEU334A, LEU337B, LEU340B, LEU358A, LEU363A, LEU382A, LEU408A, LEU414A, LEU419A, LEU419B, LEU426B, LEU427B, LEU429B, LEU434A, LEU434B, LEU446B, LEU486A, LEU498A, LEU514B, LEU518B, LEU539B, LEU541B, LEU549B, LEU618B, LEU619A, LEU619B, LEU633B, LEU654B, LEU660B, LEU680B, LEU688B, LEU694A, LEU694B, LEU706A, LEU706B, LEU707A, LEU709B, LEU742A, LEU742B, LEU83B, LEU92A, LEU99A, LYS124B, LYS132A, LYS155B, LYS169A, LYS180A, LYS180B, LYS188B, LYS224A, LYS306A, LYS335B, LYS33A, LYS348B, LYS397B, LYS417A, LYS440A, LYS444A, LYS444B, LYS454B, LYS506B, LYS550B, LYS560A, LYS573A, LYS621A, LYS621B, LYS674A, LYS674B, LYS692A, LYS701B, LYS704A, LYS704B, LYS723A, LYS723B, MET50B, MET601A, MET608A, MET608B, MET712B, MET714A, PHE145A, PHE183B, PHE209B, PHE308A, PHE309A, PHE45B, PHE495A, PHE522A, PHE523A, PHE547B, PHE567A, PHE588A, PHE604A, PHE606A, PHE628B, PHE97A, PRO101A, PRO101B, PRO117A, PRO148A, PRO153B, PRO206A, PRO32A, PRO339B, PRO362A, PRO367A, PRO420A, PRO433B, PRO445B, PRO448B, PRO451B, PRO484A, PRO491A, PRO505B, PRO54B, PRO555B, PRO55B, PRO565A, PRO614B, PRO620B, PRO629B, PRO645B, PRO96A, PRO98A, SER200A, SER23A, SER26A, SER307A, SER327A, SER345B, SER350A, SER421A, SER449B, SER459B, SER501B, SER563A, SER577A, SER585A, SER595A, SER609A, SER609B, SER636B, SER637B, SER642B, SER657B, SER668B, SER697B, SER713A, SER718A, SER718B, SER728B, SER740A, SER740B, THR150A, THR166A, THR192A, THR192B, THR222A, THR245B, THR256A, THR3B, THR405A, THR409A, THR442A, THR455B, THR488A, THR496A, THR524A, THR528A, THR52B, THR531A, THR531B, THR612A, THR612B, THR650B, THR665A, THR666A, THR719A, THR719B, THR78B, TRP196A, TRP249B, TRP357A, TRP357B, TRP415A, TRP545B, TYR100A, TYR100B, TYR204A, TYR264B, TYR35A, TYR365A, TYR406A, TYR471A, TYR473B, TYR543B, TYR58B, VAL114A, VAL115A, VAL157B, VAL159B, VAL160B, VAL167A, VAL191B, VAL198A, VAL201A, VAL208B, VAL212A, VAL212B, VAL253A, VAL263B, VAL267B, VAL28A, VAL30A, VAL349B, VAL366A, VAL393B, VAL398B, VAL401B, VAL413A, VAL423A, VAL43B, VAL457B, VAL458B, VAL468A, VAL468B, VAL470A, VAL470B, VAL481A, VAL487A, VAL497A, VAL526A, VAL53B, VAL564A, VAL568A, VAL579A, VAL583A, VAL586A, VAL603A, VAL61B, VAL627B, VAL634B, VAL635B, VAL638B, VAL640B, VAL643B, VAL646B, VAL658A, VAL716A, VAL716B, VAL741A, VAL741B, VAL81B