2B5U

crystal structure of colicin e3 v206c mutant in complex with its immunity protein

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 173
  • Norm. En. per Res.: -4.1208
• Hub Node: A(2)

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	-73.2046	-62.5532	-553.719	-689.4769	173	30	6	21074	7	81	50
A-C	-35.9956	60.4966	-289.642	-265.141	182	25	6	13377	2	99	91
C-D	-97.9818	-63.0865	-551.832	-712.9003	173	28	6	21099	8	82	48

Interface residues

• A-B: ALA177A, ALA259A, ALA312A, ALA467A, ALA52B, ARG184A, ARG268A, ARG299A, ARG306A, ARG495A, ARG497A, ARG80B, ASN180A, ASN266A, ASN42B, ASN44B, ASN45B, ASN472A, ASN490A, ASN63B, ASN71B, ASP10B, ASP15B, ASP175A, ASP187A, ASP188A, ASP269A, ASP27B, ASP28B, ASP311A, ASP41B, ASP459A, ASP463A, ASP49B, ASP510A, ASP5B, ASP67B, ASP78B, ASP81B, CYS206A, CYS47B, GLN263A, GLN489A, GLN512A, GLN59B, GLN65B, GLU14B, GLU19B, GLU20B, GLU302A, GLU303A, GLU309A, GLU33B, GLU471A, GLU53B, GLU72B, GLY130A, GLY18B, GLY1B, GLY201A, GLY226A, GLY260A, GLY264A, GLY265A, GLY26B, GLY29B, GLY36B, GLY456A, GLY461A, GLY46B, GLY482A, GLY491A, GLY492A, GLY493A, GLY82B, HIS314A, HIS462A, HIS465A, HIS64B, ILE483A, ILE51B, ILE66B, ILE68B, LEU131A, LEU2B, LEU35B, LEU479A, LEU4B, LEU551A, LEU57B, LEU58B, LYS11B, LYS176A, LYS17B, LYS23B, LYS3B, LYS40B, LYS455A, LYS458A, LYS469A, LYS480A, LYS485A, LYS488A, LYS494A, LYS496A, LYS533A, MET204A, MET32B, PHE129A, PHE16B, PHE25B, PHE261A, PHE39B, PHE457A, PHE48B, PHE62B, PHE74B, PHE77B, PHE9B, PRO203A, PRO207A, PRO225A, PRO315A, PRO38B, PRO466A, PRO468A, PRO481A, PRO484A, PRO487A, PRO532A, PRO56B, PRO60B, SER12B, SER205A, SER30B, SER34B, SER511A, SER69B, SER76B, THR13B, THR178A, THR262A, THR267A, THR313A, THR470A, THR486A, THR499A, THR7B, TRP310A, TRP498A, TRP509A, TRP54B, TRP84B, TRP8B, TYR21B, TYR284A, TYR460A, TYR464A, TYR61B, TYR73B, TYR79B, VAL179A, VAL181A, VAL186A, VAL199A, VAL202A, VAL208A, VAL31B, VAL37B, VAL43B, VAL50B, VAL55B, VAL75B
• A-C: ALA326A, ALA326C, ALA328A, ALA328C, ALA333A, ALA333C, ALA338A, ALA338C, ALA347A, ALA347C, ALA379A, ALA379C, ALA384A, ALA384C, ALA393A, ALA393C, ALA409A, ALA409C, ALA410A, ALA410C, ALA413A, ALA413C, ALA414A, ALA414C, ALA415A, ALA421A, ALA421C, ALA424A, ALA424C, ARG193A, ARG193C, ARG257A, ARG257C, ARG321A, ARG321C, ARG325A, ARG325C, ARG327A, ARG327C, ARG339A, ARG339C, ARG343A, ARG343C, ARG354A, ARG354C, ARG377A, ARG377C, ARG388A, ARG388C, ARG399A, ARG399C, ASN195A, ASN195C, ASN251A, ASN251C, ASN322A, ASN322C, ASN331A, ASN331C, ASN334C, ASN340A, ASN340C, ASN376A, ASN376C, ASN405A, ASN405C, ASN406A, ASN406C, ASP191A, ASP191C, ASP253A, ASP253C, ASP255A, ASP255C, ASP336A, ASP336C, ASP381A, ASP381C, ASP403A, ASP403C, ASP412A, ASP412C, ASP420A, ASP420C, GLN143C, GLN194A, GLN194C, GLN300A, GLN300C, GLN332A, GLN332C, GLN374A, GLN374C, GLN391A, GLN391C, GLN398A, GLN398C, GLN401A, GLN401C, GLN408A, GLN408C, GLU192A, GLU192C, GLU324A, GLU324C, GLU329A, GLU329C, GLU335A, GLU335C, GLU342A, GLU342C, GLU417A, GLU417C, GLY138A, GLY138C, GLY385A, GLY385C, GLY386A, GLY386C, GLY394A, GLY394C, HIS380A, HIS380C, HIS387A, HIS387C, LEU140A, LEU140C, LEU330A, LEU330C, LEU395A, LEU395C, LYS190A, LYS190C, LYS254A, LYS254C, LYS346A, LYS346C, LYS373A, LYS396A, LYS396C, LYS407A, LYS407C, LYS416A, LYS416C, LYS418A, LYS418C, LYS435A, LYS435C, LYS438A, MET383A, MET383C, MET389A, MET389C, MET392A, MET392C, PHE375A, PHE375C, PHE378A, PHE378C, PHE411A, PHE411C, PRO382A, PRO382C, THR249A, THR252A, THR252C, THR402A, THR402C, TRP390A, TRP390C, TYR323A, TYR323C, VAL139A, VAL139C, VAL189A, VAL296A, VAL296C, VAL337C, VAL350A, VAL350C, VAL404A, VAL404C
• C-D: ALA177C, ALA259C, ALA312C, ALA467C, ALA52D, ARG184C, ARG268C, ARG299C, ARG306C, ARG495C, ARG497C, ARG80D, ASN180C, ASN266C, ASN42D, ASN44D, ASN45D, ASN472C, ASN490C, ASN63D, ASN71D, ASP10D, ASP15D, ASP175C, ASP187C, ASP188C, ASP269C, ASP27D, ASP28D, ASP311C, ASP41D, ASP459C, ASP463C, ASP49D, ASP510C, ASP5D, ASP67D, ASP70D, ASP78D, ASP81D, CYS206C, CYS47D, GLN263C, GLN489C, GLN512C, GLN59D, GLN65D, GLU14D, GLU19D, GLU302C, GLU303C, GLU309C, GLU33D, GLU471C, GLU53D, GLU72D, GLY130C, GLY18D, GLY1D, GLY201C, GLY226C, GLY260C, GLY264C, GLY265C, GLY26D, GLY29D, GLY36D, GLY456C, GLY461C, GLY46D, GLY482C, GLY491C, GLY492C, GLY493C, GLY82D, HIS314C, HIS462C, HIS465C, HIS64D, ILE224C, ILE483C, ILE51D, ILE66D, ILE68D, LEU131C, LEU2D, LEU35D, LEU479C, LEU4D, LEU551C, LEU57D, LEU58D, LYS11D, LYS176C, LYS17D, LYS23D, LYS3D, LYS40D, LYS455C, LYS458C, LYS469C, LYS480C, LYS485C, LYS488C, LYS494C, LYS496C, LYS533C, MET204C, MET32D, PHE129C, PHE16D, PHE25D, PHE261C, PHE39D, PHE457C, PHE48D, PHE62D, PHE74D, PHE77D, PHE9D, PRO203C, PRO207C, PRO225C, PRO315C, PRO38D, PRO466C, PRO468C, PRO481C, PRO484C, PRO487C, PRO56D, PRO60D, SER12D, SER205C, SER30D, SER34D, SER511C, SER69D, SER76D, THR13D, THR178C, THR262C, THR267C, THR313C, THR470C, THR486C, THR499C, THR7D, TRP310C, TRP498C, TRP509C, TRP54D, TRP84D, TRP8D, TYR21D, TYR284C, TYR460C, TYR464C, TYR61D, TYR73D, TYR79D, VAL179C, VAL181C, VAL186C, VAL199C, VAL202C, VAL208C, VAL31D, VAL37D, VAL43D, VAL50D, VAL55D, VAL75D