3GWJ

crystal structure of antheraea pernyi arylphorin

• Total interactions analyzed: 15
• Total true interactions: 12
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 204
  • Norm. En. per Res.: -2.9818
• 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	-33.7781	16.9655	528.445	511.6325	119	14	4	9753	0	36	41
A-C	-17.6517	19.5041	533.66	535.5124	118	19	4	9374	0	34	37
A-D	-21.6537	-1.4902	-585.144	-608.2879	204	22	11	24045	0	39	27
A-E	0.0	8.0236	-101.604	-93.5804	82	0	0	3772	0	15	18
B-C	-27.6313	11.7752	488.535	472.679	122	16	4	9573	0	35	39
B-D	0.0	7.9005	-100.717	-92.8165	82	0	0	3738	0	14	15
B-F	-15.43	-4.9438	-599.137	-619.5107	210	28	11	24493	0	40	29
C-E	-9.298	-3.9024	-580.955	-594.1554	204	22	11	23839	0	40	28
C-F	0.0	8.4683	-104.665	-96.1967	82	0	0	3797	0	15	17
D-E	-40.2711	14.6914	514.326	488.7463	121	18	4	9529	0	38	40
D-F	-18.2719	23.1325	523.451	528.3116	121	19	4	9752	0	35	41
E-F	-34.567	20.597	572.484	558.5141	117	15	4	9046	0	36	38

Interface residues

• A-B: ALA320A, ALA320B, ALA328A, ALA328B, ARG316A, ARG373A, ARG418B, ARG72A, ASN311A, ASN323A, ASN323B, ASN520B, ASN522B, ASN530B, ASP319A, ASP319B, ASP358A, ASP370A, ASP391A, ASP646B, ASP87A, ASP91A, CYS649B, CYS73A, GLN327A, GLN327B, GLN330B, GLN339A, GLN372A, GLN425B, GLN428B, GLN435B, GLU275B, GLU309A, GLU310A, GLU313A, GLU322A, GLU322B, GLU335A, GLU335B, GLU431B, GLU521B, GLU529B, GLY332B, GLY336A, GLY338A, GLY421B, GLY74A, HIS307A, ILE273B, ILE315A, ILE419B, LEU318A, LEU318B, LEU329B, LEU343B, LEU362A, LEU430B, LEU68A, LYS283B, LYS314A, LYS331A, LYS331B, LYS369A, LYS388A, LYS392A, LYS427B, LYS69A, LYS88A, MET70A, PHE276B, PHE317A, PHE325A, PHE325B, PHE334A, PHE337A, PHE351A, PHE390A, PHE426B, PHE524B, PHE650B, PRO274B, PRO281B, PRO389A, PRO432B, PRO525B, PRO644B, SER277B, SER280B, SER308A, SER374A, SER434B, SER648B, THR272B, THR340A, THR340B, THR527B, THR647B, TRP278B, TRP356B, TYR279A, TYR279B, TYR312A, TYR321A, TYR324A, TYR324B, TYR342B, TYR355A, TYR363A, TYR371A, TYR375A, TYR375B, TYR422B, TYR429B, TYR71A, VAL282B, VAL326B, VAL333B, VAL378A
• A-C: ALA320A, ALA320C, ALA328A, ALA328C, ARG316C, ARG373C, ARG418A, ARG72C, ASN311C, ASN323A, ASN323C, ASN520A, ASN522A, ASN530A, ASP319A, ASP319C, ASP358C, ASP370C, ASP391C, ASP646A, ASP87C, ASP91C, CYS649A, CYS73C, GLN327A, GLN327C, GLN330A, GLN339C, GLN372C, GLN425A, GLN428A, GLN435A, GLU275A, GLU309C, GLU310C, GLU313C, GLU322A, GLU322C, GLU335A, GLU335C, GLU376C, GLU431A, GLU521A, GLU529A, GLY332A, GLY336C, GLY338C, GLY421A, GLY74C, HIS307C, ILE273A, ILE315C, ILE419A, LEU318A, LEU318C, LEU329A, LEU343A, LEU362C, LEU430A, LEU68C, LYS283A, LYS314C, LYS331A, LYS331C, LYS369C, LYS388C, LYS392C, LYS427A, LYS69C, LYS88C, MET70C, PHE276A, PHE317C, PHE325A, PHE325C, PHE334C, PHE337C, PHE351C, PHE390C, PHE426A, PHE524A, PHE650A, PRO274A, PRO281A, PRO389C, PRO432A, PRO525A, PRO644A, SER277A, SER280A, SER308C, SER374C, SER648A, THR272A, THR340A, THR340C, THR527A, THR647A, TRP278A, TRP356A, TYR279A, TYR279C, TYR312C, TYR321C, TYR324A, TYR324C, TYR342A, TYR355C, TYR363C, TYR371C, TYR375A, TYR375C, TYR422A, TYR429A, TYR71C, VAL282A, VAL326A, VAL333A
• A-D: ALA178A, ALA178D, ALA179A, ALA179D, ALA200A, ALA200D, ALA385A, ALA385D, ALA386A, ALA386D, ARG166A, ARG166D, ARG300A, ARG300D, ASN121A, ASN121D, ASN157A, ASN157D, ASN171A, ASN171D, ASN175A, ASN175D, ASN196A, ASN196D, ASN199A, ASN199D, ASN205A, ASN205D, ASN302A, ASN302D, ASN305A, ASN305D, ASN37A, ASN37D, ASN39A, ASN39D, ASN80A, ASN80D, ASP159A, ASP159D, ASP32A, ASP32D, ASP34A, ASP34D, ASP391A, ASP391D, GLN122A, GLN122D, GLN170A, GLN170D, GLN208A, GLN208D, GLN299A, GLN299D, GLN35A, GLN35D, GLU153A, GLU181A, GLU181D, GLU309A, GLU309D, GLU310A, GLU310D, GLU472A, GLU472D, GLU473A, GLU473D, GLU474A, GLU474D, GLU81A, GLU81D, GLY172A, GLY172D, GLY384A, GLY384D, HIS286A, HIS286D, HIS307A, HIS307D, ILE158A, ILE158D, ILE174A, ILE174D, ILE184A, ILE184D, ILE201A, ILE201D, LEU173A, LEU173D, LEU289A, LEU289D, LEU290A, LEU290D, LEU36A, LEU36D, LEU470A, LEU470D, LEU475A, LEU475D, LYS163A, LYS163D, LYS168A, LYS168D, LYS283A, LYS283D, LYS388A, LYS388D, LYS78A, LYS78D, MET164A, MET164D, MET169A, MET169D, MET396A, MET396D, PHE165A, PHE165D, PHE297A, PHE297D, PHE303A, PHE303D, PHE390A, PHE390D, PHE395A, PHE395D, PHE469A, PHE469D, PRO176A, PRO176D, PRO281A, PRO281D, PRO288A, PRO288D, PRO296A, PRO296D, PRO301A, PRO301D, PRO387A, PRO387D, PRO389A, PRO389D, PRO397A, PRO397D, PRO77A, PRO77D, SER198A, SER198D, SER292A, SER292D, SER298A, SER298D, SER308A, SER308D, THR160A, THR160D, THR161A, THR161D, THR167A, THR167D, THR202A, THR202D, THR291A, THR291D, THR295A, THR295D, THR38A, THR38D, THR394A, THR394D, THR467A, THR467D, THR471A, THR471D, TYR162A, TYR162D, TYR182A, TYR182D, TYR203A, TYR203D, TYR204A, TYR204D, TYR287A, TYR287D, TYR293A, TYR293D, TYR294A, TYR294D, TYR304A, TYR304D, TYR312A, TYR393A, TYR393D, TYR43A, TYR43D, TYR671A, TYR671D, TYR79A, TYR79D, VAL282A, VAL282D, VAL306A, VAL306D, VAL468A, VAL468D
• A-E: ALA200A, ALA200E, ARG209A, ARG209E, ASN196A, ASN196E, ASN199A, ASN199E, ASN205A, ASN205E, ASN268A, ASN268E, ASN520A, ASN520E, ASN522A, ASN522E, GLN208A, GLN208E, GLU206A, GLU206E, GLU521A, GLU521E, GLU667A, GLU667E, GLU672A, GLU672E, GLY269A, GLY269E, GLY271A, GLY271E, GLY523A, GLY523E, GLY604A, GLY604E, GLY605A, GLY605E, HIS669A, HIS669E, ILE201A, ILE201E, LEU266A, LEU266E, LEU270A, LEU270E, LYS283A, LYS283E, LYS603A, LYS603E, PHE303A, PHE303E, PHE524A, PHE524E, PHE606A, PHE606E, PRO525A, PRO525E, PRO607A, PRO607E, SER198A, SER198E, SER661A, SER661E, THR202A, THR202E, THR602A, THR602E, TYR197A, TYR197E, TYR203A, TYR203E, TYR204A, TYR204E, TYR519A, TYR519E, TYR663A, TYR663E, TYR668A, TYR668E, TYR671A, TYR671E, VAL675A, VAL675E
• B-C: ALA320B, ALA320C, ALA328B, ALA328C, ARG316B, ARG373B, ARG418C, ARG72B, ASN311B, ASN323B, ASN323C, ASN344C, ASN520C, ASN522C, ASN530C, ASP319B, ASP319C, ASP358B, ASP370B, ASP391B, ASP646C, ASP87B, ASP91B, CYS649C, CYS73B, GLN327B, GLN327C, GLN330C, GLN339B, GLN372B, GLN425C, GLN428C, GLN435C, GLU275C, GLU309B, GLU310B, GLU313B, GLU322B, GLU322C, GLU335B, GLU335C, GLU376B, GLU431C, GLU436C, GLU521C, GLU529C, GLY332C, GLY336B, GLY338B, GLY421C, GLY74B, HIS307B, ILE273C, ILE315B, ILE419C, LEU318B, LEU318C, LEU329C, LEU343C, LEU362B, LEU430C, LEU68B, LYS283C, LYS314B, LYS331B, LYS331C, LYS369B, LYS388B, LYS392B, LYS427C, LYS69B, LYS88B, MET70B, PHE276C, PHE317B, PHE325B, PHE325C, PHE334B, PHE337B, PHE351B, PHE390B, PHE426C, PHE524C, PHE650C, PRO274C, PRO281C, PRO389B, PRO432C, PRO525C, PRO644C, SER277C, SER280C, SER308B, SER374B, SER434C, SER648C, THR272C, THR340B, THR340C, THR527C, THR647C, TRP278C, TRP356C, TYR279B, TYR279C, TYR312B, TYR321B, TYR324B, TYR324C, TYR342C, TYR355B, TYR363B, TYR371B, TYR375B, TYR375C, TYR422C, TYR429C, TYR71B, VAL282C, VAL326B, VAL326C, VAL333C
• B-D: ALA200B, ALA200D, ARG209B, ARG209D, ASN196B, ASN196D, ASN199B, ASN199D, ASN205B, ASN205D, ASN268B, ASN268D, ASN520B, ASN520D, ASN522B, ASN522D, GLN208B, GLN208D, GLU206B, GLU206D, GLU521B, GLU521D, GLU667B, GLU667D, GLU672B, GLU672D, GLY269B, GLY269D, GLY271B, GLY271D, GLY523B, GLY523D, GLY604B, GLY604D, GLY605B, GLY605D, HIS669B, HIS669D, ILE201B, ILE201D, LEU266B, LEU266D, LEU270B, LEU270D, LYS283B, LYS283D, LYS603B, LYS603D, PHE303B, PHE303D, PHE524B, PHE524D, PHE606B, PHE606D, PRO525B, PRO525D, PRO607B, PRO607D, SER198B, SER198D, SER661B, SER661D, THR202B, THR202D, THR602B, THR602D, TYR197B, TYR197D, TYR203B, TYR203D, TYR204B, TYR204D, TYR519B, TYR519D, TYR663B, TYR663D, TYR668B, TYR668D, TYR671B, TYR671D, VAL675B, VAL675D
• B-F: ALA178B, ALA178F, ALA179B, ALA179F, ALA200B, ALA200F, ALA385B, ALA385F, ALA386B, ALA386F, ARG166B, ARG166F, ARG300B, ARG300F, ASN157B, ASN157F, ASN171B, ASN171F, ASN175B, ASN175F, ASN196B, ASN196F, ASN199B, ASN199F, ASN205B, ASN205F, ASN302B, ASN302F, ASN305B, ASN305F, ASN311F, ASN37B, ASN37F, ASN39B, ASN39F, ASN80B, ASN80F, ASP159B, ASP159F, ASP32B, ASP32F, ASP34B, ASP34F, ASP391B, ASP391F, GLN122B, GLN122F, GLN170B, GLN170F, GLN208B, GLN208F, GLN299B, GLN299F, GLN35B, GLN35F, GLU153F, GLU181B, GLU181F, GLU309B, GLU309F, GLU310B, GLU310F, GLU472B, GLU472F, GLU473B, GLU473F, GLU474B, GLU474F, GLU81B, GLU81F, GLY172B, GLY172F, GLY183B, GLY285B, GLY285F, GLY384B, GLY384F, HIS286B, HIS286F, HIS307B, HIS307F, ILE158B, ILE158F, ILE174B, ILE174F, ILE184B, ILE184F, ILE201B, ILE201F, LEU173B, LEU173F, LEU289B, LEU289F, LEU290B, LEU290F, LEU36B, LEU36F, LEU470B, LEU470F, LEU475B, LEU475F, LYS163B, LYS163F, LYS168B, LYS168F, LYS283B, LYS283F, LYS388B, LYS388F, LYS47B, LYS47F, LYS78B, LYS78F, MET164B, MET164F, MET169B, MET169F, MET396B, MET396F, PHE165B, PHE165F, PHE297B, PHE297F, PHE303B, PHE303F, PHE390B, PHE390F, PHE395B, PHE395F, PHE469B, PHE469F, PRO176B, PRO176F, PRO281B, PRO281F, PRO288B, PRO288F, PRO296B, PRO296F, PRO301B, PRO301F, PRO387B, PRO387F, PRO389B, PRO389F, PRO397B, PRO397F, PRO77B, PRO77F, SER198B, SER198F, SER292B, SER292F, SER298B, SER298F, SER308B, SER308F, SER398B, SER398F, THR160B, THR160F, THR161B, THR161F, THR167B, THR167F, THR202B, THR202F, THR291B, THR291F, THR295B, THR295F, THR38B, THR38F, THR394B, THR394F, THR467B, THR467F, THR471B, THR471F, TYR162B, TYR162F, TYR182B, TYR182F, TYR203B, TYR203F, TYR204B, TYR204F, TYR287B, TYR287F, TYR293B, TYR293F, TYR294B, TYR294F, TYR304B, TYR304F, TYR312B, TYR393B, TYR393F, TYR43B, TYR43F, TYR671B, TYR671F, TYR79B, TYR79F, VAL282B, VAL282F, VAL306B, VAL306F, VAL468B, VAL468F
• C-E: ALA178C, ALA178E, ALA179C, ALA179E, ALA200C, ALA200E, ALA385C, ALA385E, ALA386C, ALA386E, ARG166C, ARG166E, ARG300C, ARG300E, ASN121E, ASN157C, ASN157E, ASN171C, ASN171E, ASN175C, ASN175E, ASN196C, ASN196E, ASN199C, ASN199E, ASN205C, ASN205E, ASN302C, ASN302E, ASN305C, ASN305E, ASN37C, ASN37E, ASN39C, ASN39E, ASN80C, ASN80E, ASP159C, ASP159E, ASP32C, ASP32E, ASP34C, ASP34E, ASP391C, ASP391E, GLN122C, GLN122E, GLN170C, GLN170E, GLN208C, GLN208E, GLN299C, GLN299E, GLN35C, GLN35E, GLU153E, GLU181C, GLU181E, GLU309C, GLU309E, GLU310C, GLU310E, GLU472C, GLU472E, GLU473C, GLU473E, GLU474C, GLU474E, GLU81C, GLY172C, GLY172E, GLY384C, GLY384E, HIS286C, HIS286E, HIS307C, HIS307E, ILE158C, ILE158E, ILE174C, ILE174E, ILE184C, ILE184E, ILE201C, ILE201E, LEU173C, LEU173E, LEU289C, LEU289E, LEU290C, LEU290E, LEU36C, LEU36E, LEU470C, LEU470E, LEU475C, LEU475E, LEU76E, LYS163C, LYS163E, LYS168C, LYS168E, LYS283C, LYS283E, LYS388C, LYS388E, LYS47C, LYS78C, LYS78E, MET164C, MET164E, MET169C, MET169E, MET396C, MET396E, PHE165C, PHE165E, PHE297C, PHE297E, PHE303C, PHE303E, PHE390C, PHE390E, PHE395C, PHE395E, PHE469C, PHE469E, PRO176C, PRO176E, PRO281C, PRO281E, PRO288C, PRO288E, PRO296C, PRO296E, PRO301C, PRO301E, PRO387C, PRO387E, PRO389C, PRO389E, PRO397C, PRO397E, PRO77C, PRO77E, SER198C, SER198E, SER292C, SER292E, SER298C, SER298E, SER308C, SER308E, THR160C, THR160E, THR161C, THR161E, THR167C, THR167E, THR202C, THR202E, THR291C, THR291E, THR295C, THR295E, THR38C, THR38E, THR394C, THR394E, THR467C, THR467E, THR471C, THR471E, TYR162C, TYR162E, TYR182C, TYR182E, TYR203C, TYR203E, TYR204C, TYR204E, TYR287C, TYR287E, TYR293C, TYR293E, TYR294C, TYR294E, TYR304C, TYR304E, TYR312E, TYR393C, TYR393E, TYR43C, TYR43E, TYR671C, TYR671E, TYR79C, TYR79E, VAL282C, VAL282E, VAL306C, VAL306E, VAL468C, VAL468E
• C-F: ALA200C, ALA200F, ARG209C, ARG209F, ASN196C, ASN196F, ASN199C, ASN199F, ASN205C, ASN205F, ASN268C, ASN268F, ASN520C, ASN520F, ASN522C, ASN522F, GLN208C, GLN208F, GLU206C, GLU206F, GLU521C, GLU521F, GLU667C, GLU667F, GLU672C, GLU672F, GLY269C, GLY269F, GLY271C, GLY271F, GLY523C, GLY523F, GLY604C, GLY604F, GLY605C, GLY605F, HIS669C, HIS669F, ILE201C, ILE201F, LEU266C, LEU266F, LEU270C, LEU270F, LYS283C, LYS283F, LYS603C, LYS603F, PHE303C, PHE303F, PHE524C, PHE524F, PHE606C, PHE606F, PRO525C, PRO525F, PRO607C, PRO607F, SER198C, SER198F, SER661C, SER661F, THR202C, THR202F, THR602C, THR602F, TYR197C, TYR197F, TYR203C, TYR203F, TYR204C, TYR204F, TYR519C, TYR519F, TYR663C, TYR663F, TYR668C, TYR668F, TYR671C, TYR671F, VAL675C, VAL675F
• D-E: ALA320D, ALA320E, ALA328D, ALA328E, ARG316D, ARG373D, ARG418E, ARG72D, ASN305D, ASN311D, ASN323D, ASN323E, ASN520E, ASN522E, ASN530E, ASP319D, ASP319E, ASP358D, ASP370D, ASP391D, ASP646E, ASP87D, ASP91D, CYS649E, CYS73D, GLN327D, GLN327E, GLN330E, GLN339D, GLN372D, GLN425E, GLN428E, GLN435E, GLU275E, GLU309D, GLU310D, GLU313D, GLU322D, GLU322E, GLU335D, GLU335E, GLU431E, GLU436E, GLU521E, GLU529E, GLY332E, GLY336D, GLY338D, GLY421E, GLY74D, HIS307D, ILE273E, ILE315D, ILE419E, LEU318D, LEU318E, LEU329E, LEU343E, LEU362D, LEU430E, LEU68D, LYS283E, LYS314D, LYS331D, LYS331E, LYS369D, LYS388D, LYS392D, LYS427E, LYS69D, LYS88D, MET70D, PHE276E, PHE317D, PHE325D, PHE325E, PHE334D, PHE337D, PHE351D, PHE390D, PHE426E, PHE524E, PHE650E, PRO274E, PRO281E, PRO389D, PRO432E, PRO525E, PRO644E, SER277E, SER280E, SER308D, SER374D, SER434E, SER648E, THR272E, THR340D, THR340E, THR527E, THR647E, TRP278E, TRP356E, TYR279D, TYR279E, TYR312D, TYR321D, TYR324D, TYR324E, TYR342E, TYR355D, TYR363D, TYR371D, TYR375D, TYR375E, TYR422E, TYR429E, TYR71D, VAL282E, VAL326E, VAL333E, VAL378D
• D-F: ALA320D, ALA320F, ALA328D, ALA328F, ARG316F, ARG373F, ARG418D, ARG72F, ASN311F, ASN323D, ASN323F, ASN344D, ASN520D, ASN522D, ASN530D, ASP319D, ASP319F, ASP358F, ASP370F, ASP391F, ASP646D, ASP87F, ASP91F, CYS649D, CYS73F, GLN327D, GLN327F, GLN330D, GLN339F, GLN372F, GLN414D, GLN425D, GLN428D, GLN435D, GLU275D, GLU309F, GLU310F, GLU313F, GLU322D, GLU322F, GLU335D, GLU335F, GLU431D, GLU436D, GLU521D, GLU529D, GLY332D, GLY336F, GLY338F, GLY421D, GLY74F, HIS307F, ILE273D, ILE315F, ILE419D, LEU318D, LEU318F, LEU329D, LEU343D, LEU362F, LEU430D, LEU68F, LYS283D, LYS314F, LYS331D, LYS331F, LYS369F, LYS388F, LYS392F, LYS427D, LYS69F, LYS88F, MET70F, PHE276D, PHE317F, PHE325D, PHE325F, PHE334F, PHE337F, PHE351F, PHE390F, PHE426D, PHE524D, PHE650D, PRO274D, PRO281D, PRO389F, PRO432D, PRO525D, PRO644D, SER277D, SER280D, SER308F, SER374F, SER434D, SER648D, THR272D, THR340D, THR340F, THR527D, THR647D, TRP278D, TRP356D, TYR279D, TYR279F, TYR312F, TYR321F, TYR324D, TYR324F, TYR342D, TYR355F, TYR363F, TYR371F, TYR375D, TYR375F, TYR422D, TYR429D, TYR71F, VAL282D, VAL326D, VAL333D
• E-F: ALA320E, ALA320F, ALA328E, ALA328F, ARG316E, ARG373E, ARG418F, ARG72E, ASN311E, ASN323E, ASN323F, ASN520F, ASN522F, ASN530F, ASP319E, ASP319F, ASP358E, ASP370E, ASP391E, ASP646F, ASP87E, ASP91E, CYS649F, CYS73E, GLN327E, GLN327F, GLN330F, GLN339E, GLN372E, GLN425F, GLN428F, GLN435F, GLU275F, GLU309E, GLU310E, GLU313E, GLU322E, GLU322F, GLU335E, GLU335F, GLU431F, GLU521F, GLU529F, GLY332F, GLY336E, GLY338E, GLY421F, GLY74E, HIS307E, ILE273F, ILE315E, ILE419F, LEU318E, LEU318F, LEU329F, LEU343F, LEU362E, LEU430F, LYS283F, LYS314E, LYS331E, LYS331F, LYS369E, LYS388E, LYS392E, LYS427F, LYS69E, LYS88E, MET70E, PHE276F, PHE317E, PHE325E, PHE325F, PHE334E, PHE337E, PHE351E, PHE390E, PHE426F, PHE524F, PHE650F, PRO274F, PRO281F, PRO389E, PRO432F, PRO525F, PRO644F, SER277F, SER280F, SER308E, SER374E, SER434F, SER648F, THR272F, THR340E, THR340F, THR527F, THR647F, TRP278F, TRP356F, TYR279E, TYR279F, TYR312E, TYR321E, TYR324E, TYR324F, TYR342F, TYR355E, TYR363E, TYR371E, TYR375E, TYR375F, TYR422F, TYR429F, TYR71E, VAL282F, VAL326F, VAL333F