1NYE

crystal structure of osmc from e. coli

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 236
  • Norm. En. per Res.: -5.4221
• Hub Node: A(4)

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	-298.9536	-48.1509	-932.521	-1279.6255	236	109	37	41082	8	66	63
A-D	-60.6992	-26.4596	-171.97	-259.1288	72	19	3	7123	4	31	18
A-E	0.0	-5.2918	-3.517	-8.8089	12	0	0	319	0	7	11
A-F	0.0	-12.8179	-113.484	-126.3019	38	6	3	4244	1	9	7
B-C	0.0	4.6972	-15.0847	-10.3875	11	4	0	595	0	10	11
B-D	-12.7682	-3.1631	-109.727	-125.6582	36	9	3	4156	0	5	6
B-E	0.0	0.0	-13.4278	-13.4278	8	1	0	469	0	3	1
B-F	-45.1519	-4.8986	-181.677	-231.7275	70	16	3	7533	2	31	19
C-D	-284.9526	-44.9466	-908.296	-1238.1952	247	99	37	41313	8	71	66
E-F	-284.0376	-35.8092	-923.781	-1243.6278	242	106	37	40441	8	66	65

Interface residues

• A-B: ALA102A, ALA114A, ALA119A, ALA125A, ALA153A, ALA229B, ALA274B, ALA275B, ALA277B, ALA278B, ALA283B, ALA291B, ALA29A, ALA302B, ALA314B, ALA319B, ALA325B, ALA353B, ALA74A, ALA75A, ALA77A, ALA78A, ALA83A, ALA91A, ARG237B, ARG259B, ARG37A, ARG59A, ASN250B, ASN257B, ASN267B, ASN50A, ASN57A, ASN67A, ASP103A, ASP107A, ASP110A, ASP234B, ASP299B, ASP303B, ASP307B, ASP310B, ASP34A, ASP99A, CYS145A, CYS279B, CYS345B, CYS79A, GLN149A, GLN228B, GLN251B, GLN252B, GLN28A, GLN349B, GLN51A, GLN52A, GLU123A, GLU154A, GLU232B, GLU245B, GLU261B, GLU263B, GLU269B, GLU270B, GLU290B, GLU323B, GLU32A, GLU354B, GLU45A, GLU61A, GLU63A, GLU69A, GLU70A, GLU90A, GLY112A, GLY144A, GLY227B, GLY233B, GLY238B, GLY240B, GLY247B, GLY255B, GLY262B, GLY265B, GLY273B, GLY27A, GLY289B, GLY292B, GLY312B, GLY33A, GLY344B, GLY38A, GLY40A, GLY47A, GLY55A, GLY62A, GLY65A, GLY73A, GLY89A, GLY92A, HIS224B, HIS230B, HIS24A, HIS276B, HIS30A, HIS76A, ILE115A, ILE118A, ILE155A, ILE223B, ILE235B, ILE23A, ILE272B, ILE298B, ILE315B, ILE318B, ILE355B, ILE35A, ILE72A, ILE98A, LEU106A, LEU120A, LEU151A, LEU249B, LEU271B, LEU284B, LEU286B, LEU288B, LEU306B, LEU320B, LEU351B, LEU49A, LEU71A, LEU84A, LEU86A, LEU88A, LYS108A, LYS117A, LYS121A, LYS152A, LYS162A, LYS225B, LYS226B, LYS236B, LYS239B, LYS25A, LYS264B, LYS26A, LYS308B, LYS317B, LYS321B, LYS352B, LYS36A, LYS39A, LYS64A, MET21A, MET221B, MET282B, MET287B, MET82A, MET87A, PHE113A, PHE256B, PHE260B, PHE280B, PHE293B, PHE313B, PHE56A, PHE60A, PHE80A, PHE93A, PRO127A, PRO146A, PRO253B, PRO268B, PRO295B, PRO346B, PRO53A, PRO68A, PRO95A, SER105A, SER122A, SER148A, SER243B, SER246B, SER281B, SER285B, SER297B, SER305B, SER322B, SER348B, SER43A, SER46A, SER81A, SER85A, SER97A, THR100A, THR101A, THR116A, THR222B, THR22A, THR241B, THR244B, THR258B, THR266B, THR294B, THR296B, THR300B, THR301B, THR316B, THR41A, THR44A, THR58A, THR66A, THR94A, THR96A, TRP231B, TRP31A, TYR254B, TYR54A, VAL104A, VAL109A, VAL124A, VAL126A, VAL147A, VAL150A, VAL242B, VAL248B, VAL304B, VAL309B, VAL324B, VAL326B, VAL347B, VAL350B, VAL42A, VAL48A
• A-D: ALA119A, ALA131A, ALA141A, ALA143A, ALA153A, ALA78A, ALA83A, ASN614D, ASP135A, ASP158A, ASP606D, ASP608D, CYS145A, CYS79A, GLN139A, GLN149A, GLN160A, GLN618D, GLU123A, GLU154A, GLU613D, GLU90A, GLY144A, GLY619D, GLY89A, HIS602D, HIS603D, HIS604D, HIS605D, HIS620D, HIS624D, ILE118A, ILE137A, ILE138A, ILE155A, ILE23A, ILE609D, LEU120A, LEU157A, LEU161A, LEU615D, LEU84A, LEU86A, LYS117A, LYS121A, LYS140A, LYS142A, LYS152A, LYS162A, LYS626D, MET21A, MET621D, MET82A, MET87A, PHE134A, PHE617D, PHE80A, PRO146A, PRO610D, SER122A, SER132A, SER148A, SER81A, SER85A, THR156A, THR611D, THR612D, TYR159A, TYR607D, TYR616D, VAL124A, VAL147A
• A-E: ASN857E, ASP907E, GLU861E, GLU863E, GLY862E, LYS108A, LYS36A, LYS908E, PHE56A, PHE856E, PHE860E, VAL909E
• A-F: ALA111A, ALA114A, ARG37A, ARG59A, ASN1014F, ASN57A, ASP107A, ASP110A, ASP34A, GLN1018F, GLU1013F, GLU61A, GLU63A, GLY1019F, GLY112A, GLY62A, HIS1020F, HIS1024F, ILE1023F, ILE115A, ILE35A, LEU1015F, LEU106A, LYS108A, LYS152A, LYS36A, MET1021F, PHE1017F, PHE113A, PHE56A, PHE60A, PRO68A, THR1012F, THR1022F, THR116A, TRP31A, TYR1016F, VAL109A
• B-C: ARG237B, ASN257B, ASP507C, ASP510C, GLU261B, ILE235B, LYS236B, LYS508C, PHE256B, PHE513C, VAL509C
• B-D: ALA311B, ALA314B, ARG259B, ASN257B, ASN614D, ASP234B, ASP307B, ASP310B, GLN618D, GLU261B, GLU613D, GLY262B, GLY312B, GLY619D, HIS620D, HIS624D, ILE235B, ILE315B, ILE623D, LEU306B, LEU615D, LYS236B, LYS308B, LYS352B, MET621D, PHE256B, PHE260B, PHE313B, PHE617D, PRO268B, THR611D, THR612D, THR622D, TRP231B, TYR616D, VAL309B
• B-E: ASN857E, GLU861E, GLU863E, GLY862E, MET221B, PHE856E, PHE860E, THR222B
• B-F: ALA283B, ALA319B, ALA331B, ALA341B, ALA343B, ALA353B, ASN1014F, ASP1006F, ASP1008F, ASP335B, ASP358B, CYS279B, CYS345B, GLN1018F, GLN339B, GLN349B, GLN360B, GLU1013F, GLU290B, GLU323B, GLU354B, GLY1019F, GLY289B, GLY344B, HIS1002F, HIS1003F, HIS1004F, HIS1005F, HIS1020F, ILE1009F, ILE1023F, ILE223B, ILE318B, ILE337B, ILE338B, ILE355B, LEU1015F, LEU284B, LEU286B, LEU288B, LEU320B, LEU357B, LEU361B, LYS317B, LYS321B, LYS340B, LYS342B, LYS362B, MET1021F, MET221B, MET282B, MET287B, PHE1017F, PHE280B, PHE334B, PRO1010F, PRO346B, SER281B, SER285B, SER322B, SER332B, SER348B, SER363B, THR1011F, THR1012F, THR356B, TYR1007F, TYR1016F, TYR359B, VAL347B
• C-D: ALA429C, ALA474C, ALA475C, ALA477C, ALA478C, ALA483C, ALA491C, ALA502C, ALA511C, ALA514C, ALA519C, ALA525C, ALA553C, ALA629D, ALA674D, ALA675D, ALA677D, ALA678D, ALA683D, ALA691D, ALA702D, ALA711D, ALA714D, ALA719D, ALA725D, ALA743D, ALA753D, ARG437C, ARG459C, ARG637D, ARG659D, ASN450C, ASN457C, ASN467C, ASN650D, ASN657D, ASN667D, ASP434C, ASP499C, ASP503C, ASP507C, ASP510C, ASP634D, ASP699D, ASP703D, ASP707D, ASP710D, CYS479C, CYS545C, CYS679D, CYS745D, GLN418C, GLN428C, GLN451C, GLN452C, GLN549C, GLN618D, GLN628D, GLN651D, GLN652D, GLN749D, GLU432C, GLU445C, GLU461C, GLU463C, GLU469C, GLU470C, GLU490C, GLU523C, GLU554C, GLU632D, GLU645D, GLU661D, GLU663D, GLU669D, GLU670D, GLU690D, GLU723D, GLU754D, GLY419C, GLY427C, GLY433C, GLY438C, GLY440C, GLY447C, GLY455C, GLY462C, GLY465C, GLY473C, GLY489C, GLY492C, GLY512C, GLY544C, GLY619D, GLY627D, GLY633D, GLY638D, GLY640D, GLY647D, GLY655D, GLY662D, GLY665D, GLY673D, GLY689D, GLY692D, GLY712D, GLY744D, HIS420C, HIS424C, HIS430C, HIS476C, HIS620D, HIS624D, HIS630D, HIS676D, ILE423C, ILE435C, ILE472C, ILE498C, ILE515C, ILE518C, ILE555C, ILE623D, ILE635D, ILE672D, ILE698D, ILE715D, ILE718D, ILE755D, LEU449C, LEU471C, LEU484C, LEU486C, LEU488C, LEU506C, LEU520C, LEU551C, LEU649D, LEU671D, LEU684D, LEU686D, LEU688D, LEU706D, LEU720D, LEU751D, LYS425C, LYS426C, LYS436C, LYS439C, LYS464C, LYS508C, LYS517C, LYS521C, LYS552C, LYS625D, LYS626D, LYS636D, LYS639D, LYS664D, LYS708D, LYS717D, LYS721D, LYS752D, MET421C, MET482C, MET487C, MET621D, MET682D, MET687D, PHE417C, PHE456C, PHE460C, PHE480C, PHE493C, PHE513C, PHE617D, PHE656D, PHE660D, PHE680D, PHE693D, PHE713D, PRO453C, PRO468C, PRO495C, PRO527C, PRO546C, PRO653D, PRO668D, PRO695D, PRO727D, PRO746D, SER443C, SER446C, SER481C, SER485C, SER497C, SER505C, SER522C, SER548C, SER643D, SER646D, SER681D, SER685D, SER697D, SER705D, SER722D, SER748D, THR422C, THR441C, THR444C, THR458C, THR466C, THR494C, THR496C, THR500C, THR501C, THR516C, THR622D, THR641D, THR644D, THR658D, THR666D, THR694D, THR696D, THR700D, THR701D, THR716D, TRP431C, TRP631D, TYR416C, TYR454C, TYR616D, TYR654D, VAL442C, VAL448C, VAL504C, VAL509C, VAL524C, VAL547C, VAL550C, VAL642D, VAL648D, VAL704D, VAL709D, VAL724D, VAL747D, VAL750D
• E-F: ALA1029F, ALA1074F, ALA1075F, ALA1077F, ALA1078F, ALA1083F, ALA1091F, ALA1102F, ALA1111F, ALA1114F, ALA1119F, ALA1125F, ALA1143F, ALA1153F, ALA829E, ALA874E, ALA875E, ALA877E, ALA878E, ALA883E, ALA891E, ALA902E, ALA911E, ALA914E, ALA919E, ALA925E, ALA953E, ARG1037F, ARG1059F, ARG837E, ARG859E, ASN1050F, ASN1057F, ASN1067F, ASN850E, ASN857E, ASN867E, ASP1034F, ASP1099F, ASP1103F, ASP1107F, ASP834E, ASP899E, ASP903E, ASP907E, ASP910E, CYS1079F, CYS1145F, CYS879E, CYS945E, GLN1018F, GLN1028F, GLN1051F, GLN1052F, GLN1149F, GLN818E, GLN828E, GLN851E, GLN852E, GLN949E, GLU1032F, GLU1045F, GLU1069F, GLU1070F, GLU1090F, GLU1123F, GLU1154F, GLU832E, GLU845E, GLU861E, GLU863E, GLU869E, GLU870E, GLU890E, GLU923E, GLU954E, GLY1019F, GLY1027F, GLY1033F, GLY1038F, GLY1040F, GLY1047F, GLY1055F, GLY1065F, GLY1073F, GLY1089F, GLY1092F, GLY1112F, GLY1144F, GLY819E, GLY827E, GLY833E, GLY838E, GLY840E, GLY847E, GLY855E, GLY862E, GLY865E, GLY873E, GLY889E, GLY892E, GLY912E, GLY944E, HIS1020F, HIS1024F, HIS1030F, HIS1076F, HIS820E, HIS824E, HIS830E, HIS876E, ILE1023F, ILE1035F, ILE1072F, ILE1098F, ILE1115F, ILE1118F, ILE1155F, ILE823E, ILE835E, ILE872E, ILE898E, ILE915E, ILE918E, ILE955E, LEU1049F, LEU1071F, LEU1084F, LEU1086F, LEU1088F, LEU1106F, LEU1120F, LEU1151F, LEU849E, LEU871E, LEU884E, LEU886E, LEU888E, LEU906E, LEU920E, LEU951E, LYS1025F, LYS1026F, LYS1036F, LYS1039F, LYS1064F, LYS1108F, LYS1117F, LYS1121F, LYS1152F, LYS825E, LYS826E, LYS836E, LYS839E, LYS864E, LYS908E, LYS917E, LYS921E, LYS952E, MET1021F, MET1082F, MET1087F, MET821E, MET882E, MET887E, PHE1017F, PHE1056F, PHE1080F, PHE1093F, PHE1113F, PHE817E, PHE856E, PHE860E, PHE880E, PHE893E, PHE913E, PRO1053F, PRO1068F, PRO1095F, PRO1146F, PRO853E, PRO868E, PRO895E, PRO927E, PRO946E, SER1043F, SER1046F, SER1081F, SER1085F, SER1097F, SER1105F, SER1122F, SER1148F, SER843E, SER846E, SER881E, SER885E, SER897E, SER905E, SER922E, SER948E, THR1022F, THR1041F, THR1044F, THR1058F, THR1066F, THR1094F, THR1096F, THR1100F, THR1101F, THR1116F, THR822E, THR841E, THR844E, THR858E, THR866E, THR894E, THR896E, THR900E, THR901E, THR916E, TRP1031F, TRP831E, TYR1016F, TYR1054F, TYR816E, TYR854E, VAL1042F, VAL1048F, VAL1104F, VAL1109F, VAL1124F, VAL1147F, VAL1150F, VAL842E, VAL848E, VAL904E, VAL909E, VAL924E, VAL926E, VAL947E, VAL950E