2OCD

crystal structure of l-asparaginase i from vibrio cholerae o1 biovar eltor str. n16961

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 173
  • Norm. En. per Res.: -3.2201
• 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	-80.2483	5.621	-482.45	-557.0773	173	19	10	19680	0	8	12
A-C	-29.3011	42.7932	-176.0	-162.5079	96	10	3	7376	0	26	21
A-D	0.0	0.0	-0.0009	-0.0009	2	0	0	2	0	0	0
B-D	-18.5346	37.175	-174.385	-155.7446	99	18	3	7612	0	25	25
C-D	-80.7097	-0.1311	-456.36	-537.2008	172	24	11	19510	0	8	11

Interface residues

• A-B: ALA100A, ALA100B, ALA166A, ALA166B, ALA171A, ALA171B, ALA237A, ALA237B, ALA248A, ALA248B, ALA276A, ALA276B, ALA308A, ALA308B, ALA66A, ALA66B, ALA95A, ALA95B, ARG162A, ARG162B, ARG228A, ARG228B, ARG264A, ASN176A, ASN176B, ASN229A, ASN229B, ASN236A, ASN236B, ASN247A, ASN247B, ASN251A, ASN251B, ASN280A, ASN280B, ASP167A, ASP167B, ASP21A, ASP300A, ASP300B, ASP59A, ASP59B, ASP62A, ASP62B, ASP67A, ASP67B, ASP92A, ASP92B, CYS274A, CYS274B, GLN211A, GLN211B, GLN233A, GLN233B, GLN250A, GLN250B, GLN273A, GLN273B, GLU225A, GLU225B, GLU304A, GLU304B, GLY168A, GLY168B, GLY214A, GLY214B, GLY221A, GLY221B, GLY244A, GLY244B, GLY246A, GLY246B, GLY277A, GLY277B, HIS165A, HIS165B, HIS311A, HIS311B, HIS89A, HIS89B, ILE213A, ILE213B, ILE216A, ILE216B, ILE222A, ILE222B, ILE227A, ILE227B, ILE239A, ILE239B, LEU231A, LEU231B, LEU232A, LEU232B, LEU241A, LEU241B, LEU275A, LEU275B, LEU307A, LEU307B, LEU310A, LYS163A, LYS163B, LYS278A, LYS278B, PHE169A, PHE169B, PHE172A, PHE243A, PHE243B, PRO175A, PRO175B, PRO210A, PRO210B, PRO212A, PRO212B, PRO220A, PRO220B, PRO234A, PRO234B, PRO249A, PRO249B, PRO303A, PRO303B, PRO65A, PRO65B, SER164A, SER164B, SER170A, SER170B, SER173A, SER173B, SER223A, SER223B, SER60A, SER60B, SER61A, SER61B, THR209A, THR217A, THR217B, THR230A, THR230B, THR242A, THR242B, THR272A, THR272B, THR286B, THR64A, THR64B, THR91A, THR91B, THR93A, THR93B, THR97A, THR97B, TRP68A, TRP68B, TYR219A, TYR219B, TYR284B, TYR96A, TYR96B, VAL215A, VAL215B, VAL226A, VAL226B, VAL235A, VAL235B, VAL245A, VAL245B, VAL279A, VAL279B
• A-C: ALA122A, ALA122C, ALA130A, ALA130C, ALA135A, ALA135C, ALA140A, ALA183A, ALA183C, ARG125A, ARG125C, ARG43A, ARG43C, ASN131A, ASN131C, ASN134A, ASN134C, ASN141A, ASN141C, ASN152A, ASN152C, ASN153A, ASN153C, ASN186A, ASN186C, ASP123A, ASP123C, ASP127A, ASP127C, ASP167A, GLN118A, GLN118C, GLN129A, GLN129C, GLU182A, GLU182C, GLU188A, GLU188C, GLU40A, GLU40C, GLU45A, GLU45C, GLY128A, GLY128C, GLY168A, GLY168C, GLY184A, GLY184C, HIS137A, HIS137C, ILE119A, ILE119C, ILE185A, ILE185C, ILE187A, ILE187C, LEU121A, LEU121C, LEU124A, LEU124C, LEU133A, LEU133C, LEU136A, LEU181A, LEU181C, LEU35A, LEU35C, LYS19A, PHE150A, PHE150C, PHE151A, PHE151C, PHE169A, PHE169C, PHE41A, PHE41C, PRO120A, PRO120C, PRO39A, PRO39C, PRO44A, PRO44C, PRO47A, PRO47C, SER117A, SER117C, SER126A, SER126C, SER170A, SER170C, SER37A, SER37C, TYR142A, TYR142C, VAL138A, VAL138C
• A-D: THR191A, THR191D
• B-D: ALA122B, ALA122D, ALA130B, ALA130D, ALA140D, ALA171B, ALA171D, ALA183B, ALA183D, ARG125B, ARG125D, ARG43B, ARG43D, ASN131B, ASN131D, ASN134B, ASN134D, ASN141B, ASN141D, ASN152B, ASN152D, ASN153B, ASN153D, ASN186B, ASN186D, ASP123B, ASP123D, ASP127B, ASP127D, ASP167B, ASP167D, GLN118B, GLN118D, GLN129B, GLN129D, GLU182B, GLU182D, GLU188B, GLU188D, GLU40B, GLU40D, GLU45B, GLU45D, GLY128B, GLY128D, GLY168B, GLY168D, GLY184B, GLY184D, HIS137B, HIS137D, HIS42D, ILE119B, ILE119D, ILE185B, ILE185D, ILE187B, ILE187D, LEU121B, LEU121D, LEU124B, LEU124D, LEU133B, LEU133D, LEU136D, LEU181B, LEU181D, LEU35B, LEU35D, LYS18B, LYS19B, PHE150B, PHE150D, PHE151B, PHE151D, PHE169B, PHE169D, PHE41B, PHE41D, PRO120B, PRO120D, PRO39B, PRO39D, PRO44B, PRO44D, PRO47B, PRO47D, SER117B, SER117D, SER126B, SER126D, SER170B, SER170D, SER37B, SER37D, TYR142B, TYR142D, VAL138B, VAL138D
• C-D: ALA100C, ALA100D, ALA166C, ALA166D, ALA171C, ALA171D, ALA237C, ALA237D, ALA248C, ALA248D, ALA276C, ALA276D, ALA285D, ALA308C, ALA308D, ALA66C, ALA66D, ALA95C, ALA95D, ARG162C, ARG162D, ARG228C, ARG228D, ARG264D, ASN176C, ASN176D, ASN229C, ASN229D, ASN236C, ASN236D, ASN247C, ASN247D, ASN251C, ASN251D, ASN280D, ASP167D, ASP21C, ASP300C, ASP59C, ASP59D, ASP62C, ASP62D, ASP67C, ASP67D, ASP92C, ASP92D, CYS274C, CYS274D, GLN211C, GLN211D, GLN233C, GLN233D, GLN250C, GLN250D, GLN273C, GLN273D, GLU225C, GLU225D, GLU304C, GLU304D, GLY168C, GLY168D, GLY214C, GLY214D, GLY221C, GLY221D, GLY244C, GLY244D, GLY246C, GLY246D, GLY277C, GLY277D, HIS165C, HIS165D, HIS224C, HIS224D, HIS311C, HIS311D, HIS89C, HIS89D, ILE213C, ILE213D, ILE216C, ILE216D, ILE222C, ILE222D, ILE227C, ILE227D, ILE239C, ILE239D, LEU231C, LEU231D, LEU232C, LEU232D, LEU241C, LEU241D, LEU275C, LEU275D, LEU307C, LEU307D, LYS163C, LYS163D, LYS278C, LYS278D, PHE169C, PHE169D, PHE243C, PHE243D, PRO175C, PRO175D, PRO210C, PRO210D, PRO212C, PRO212D, PRO220C, PRO220D, PRO234C, PRO234D, PRO249C, PRO249D, PRO303C, PRO303D, PRO65C, PRO65D, SER164C, SER164D, SER170C, SER170D, SER173C, SER173D, SER223C, SER223D, SER60C, SER60D, SER61C, SER61D, SER99D, THR217C, THR217D, THR230C, THR230D, THR242C, THR242D, THR272C, THR272D, THR286D, THR64C, THR64D, THR91C, THR91D, THR93C, THR93D, THR97C, THR97D, TRP68C, TRP68D, TYR219C, TYR219D, TYR284D, TYR96C, TYR96D, VAL215C, VAL215D, VAL226C, VAL226D, VAL235C, VAL235D, VAL245C, VAL245D, VAL25C, VAL279C, VAL279D