1TZN
crystal structure of the anthrax toxin protective antigen heptameric prepore bound to the vwa domain of cmg2, an anthrax toxin receptor
Total interactions analyzed 378
Total true interactions 28
Strongest Interaction Chains H-h
Int. Res. 96
Norm. En. per Res. -3.1854
Hub Node A(3)
Click on the Nodes or Edges in the network to see the details
Weak Strong
Width of edge <-> No. of inter. res.
All Interactions
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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 int. res.
A-a -38.6008 -40.5806 -220.911 -300.0925 97 21 6 9211 1 34 37
A-B -36.1515 -56.9447 -317.872 -410.9682 218 68 3 19934 5 87 63
A-F -62.6365 -72.3907 -360.288 -495.3153 211 52 3 19468 5 89 60
B-b -38.288 -40.5706 -221.023 -299.8815 96 20 6 9183 1 34 37
B-C -34.2792 -76.6613 -339.81 -450.7506 205 59 2 18639 3 85 60
C-c -39.7514 -40.5772 -221.711 -302.0396 96 21 6 9185 1 34 37
C-O -33.9319 -72.3232 31 ARG178C, ARG200O, ARG242O, ARG252O, ARG468O, ARG470O, ARG669O, ASP179C, ASP185C, ASP244O, ASP315C, ASP497O, ASP512C, ASP520C, GLU224C, GLU267O, GLU308C, GLU479C, GLU486C, GLU515C, HIS310C, LEU668O, LYS199O, LYS220C, LYS245O, LYS518C, LYS633O, LYS637O, THR201O, THR516C, VAL309C
D-d -41.6809 -40.5772 -220.022 -302.2801 96 22 6 9218 1 34 37
D-E -48.8108 -73.0209 -374.755 -496.5868 209 41 3 18843 4 87 60
D-O -75.8438 -63.4519 35 ARG178O, ARG200D, ARG242D, ARG252D, ARG468D, ARG470D, ARG669D, ASN415D, ASP185O, ASP244D, ASP315O, ASP497D, ASP512O, ASP520O, GLU224O, GLU267D, GLU308O, GLU479O, GLU486O, GLU515O, HIS310O, LEU514O, LYS199D, LYS220O, LYS225O, LYS245D, LYS414D, LYS637D, SER319O, SER325O, SER667D, THR201D, THR240D, THR516O, VAL471D
E-e -42.1391 -40.5714 -221.406 -304.1165 97 22 6 9249 1 34 37
E-F -38.9799 -76.6181 -361.709 -477.307 209 43 2 18905 4 90 60
F-f -38.2289 -40.5772 -221.167 -299.9731 97 22 6 9237 1 34 37
G-g -41.9722 -40.5823 -219.526 -302.0804 96 22 6 9256 1 34 37
G-H -61.1875 -68.9351 -319.014 -449.1366 216 90 2 20787 7 91 63
G-M -49.7106 -85.7375 31 ARG178M, ARG200G, ARG242G, ARG252G, ARG468G, ARG470G, ASN415G, ASP185M, ASP231M, ASP244G, ASP315M, ASP472G, ASP497G, ASP512M, ASP520M, GLU224M, GLU267G, GLU479M, GLU486M, GLU515M, HIS310M, LEU514M, LYS199G, LYS220M, LYS225M, LYS245G, LYS414G, SER325M, THR201G, THR240G, VAL471G
H-h -46.5518 -40.5753 -218.674 -305.8011 96 22 6 9269 1 34 37
H-I -42.7346 -84.2892 -322.61 -449.6338 214 88 1 19498 7 84 63
I-i -42.0289 -40.5785 21 ALA341I, ARG1111i, ARG344I, ARG659I, ASN682I, ASP1050i, ASP1148i, ASP1152i, ASP648I, ASP683I, GLU1117i, GLU1122i, GLU650I, GLU654I, GLY1116i, HIS1121i, LYS1051i, LYS1150i, LYS684I, SER1054i, TYR1119i
I-J -41.1091 -76.966 31 ARG178I, ARG200J, ARG242J, ARG252J, ARG468J, ARG470J, ARG669J, ASP185I, ASP244J, ASP315I, ASP497J, ASP512I, ASP520I, GLN670J, GLU224I, GLU267J, GLU308I, GLU479I, GLU486I, GLU515I, HIS304I, HIS310I, LEU514I, LYS199J, LYS220I, LYS245J, LYS518I, LYS637J, THR201J, THR240J, THR516I
J-j -40.6724 -40.5807 21 ALA341J, ARG1111j, ARG344J, ARG659J, ASN682J, ASP1050j, ASP1148j, ASP1152j, ASP648J, ASP683J, GLU1117j, GLU1122j, GLU650J, GLU654J, GLY1116j, HIS1121j, LYS1051j, LYS1150j, LYS684J, SER1054j, TYR1119j
J-K -38.8328 -81.954 29 ARG178J, ARG200K, ARG242K, ARG252K, ARG468K, ARG470K, ARG669K, ASP185J, ASP231J, ASP244K, ASP315J, ASP497K, ASP512J, ASP520J, GLU224J, GLU267K, GLU308J, GLU479J, GLU486J, GLU515J, HIS310J, LYS199K, LYS220J, LYS245K, LYS414K, LYS633K, THR201K, THR516J, VAL471K
K-k -37.0238 -40.5702 21 ALA341K, ARG1111k, ARG344K, ARG659K, ASN682K, ASP1050k, ASP1148k, ASP1152k, ASP648K, ASP683K, GLU1117k, GLU1122k, GLU650K, GLU654K, GLY1116k, HIS1121k, LYS1051k, LYS1150k, LYS684K, SER1054k, TYR1119k
K-L -49.6983 -73.7127 33 ARG178K, ARG200L, ARG242L, ARG252L, ARG468L, ARG470L, ARG669L, ASP185K, ASP244L, ASP315K, ASP497L, ASP512K, ASP520K, GLN670L, GLU224K, GLU267L, GLU308K, GLU479K, GLU486K, GLU515K, HIS304K, HIS310K, LEU514K, LEU668L, LYS199L, LYS220K, LYS245L, LYS518K, LYS637L, THR201L, THR240L, THR516K, VAL309K
L-l -37.6114 -40.579 22 ALA341L, ARG1111l, ARG344L, ARG659L, ASN682L, ASP1050l, ASP1148l, ASP1152l, ASP648L, ASP683L, GLU1117l, GLU1122l, GLU650L, GLU654L, GLY1116l, HIS1121l, LYS1051l, LYS1150l, LYS684L, SER1052l, SER1054l, TYR1119l
L-M -43.9731 -53.6949 31 ARG178L, ARG200M, ARG242M, ARG252M, ARG468M, ARG470M, ARG669M, ASP185L, ASP244M, ASP315L, ASP497M, ASP512L, ASP520L, GLU224L, GLU267M, GLU308L, GLU479L, GLU486L, GLU515L, HIS310L, LEU514L, LYS199M, LYS220L, LYS225L, LYS245M, LYS414M, LYS637M, SER667M, THR201M, THR240M, VAL471M
M-m -38.8271 -40.5703 21 ALA1056m, ARG1111m, ARG344M, ARG659M, ASN682M, ASP1050m, ASP1148m, ASP1152m, ASP648M, ASP683M, GLU1117m, GLU1122m, GLU650M, GLU654M, GLY1116m, HIS1121m, LYS1051m, LYS1150m, LYS684M, SER1054m, TYR688M
O-o -39.6957 -40.5713 21 ARG1111o, ARG344O, ARG659O, ASN682O, ASP1050o, ASP1148o, ASP1152o, ASP648O, ASP683O, GLU1117o, GLU1122o, GLU650O, GLU654O, GLY1116o, HIS1121o, ILE656O, LYS1051o, LYS1150o, LYS684O, SER1054o, SER1087o