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DOWNLOAD: [sequence-replaced 3D model] [for PyMOL] [3D template] [Modeller script]
ALL MOLECULES IN THE BIOLOGICAL UNIT: |
MOLECULES | contact sites | |||||
model | mark | query | asym_id oper (auth_asym_id) |
type | description | a(query A) |
1 | a | A(TLR3_HUMAN) | B 1 (B) | polymer(polypeptide(L)) [734 aa] | Toll-like receptor 8 :TLR8_HUMAN | |
2 | b | O 1 (A) | non-polymer(I5B) | (5-methoxy-6-pyridin-4-yl-1~{H}-indazol-3-yl)-(4-methylpiperazin-1-yl)methanone | 351F 353W(Y) 355K 356C(G) 388N(G) 390F(V) 416K(I) 418K(F) 440L(E) (identity: 22.2 %/29.1 %) |
ALIGNMENTS |
MODEL[1] Protein A "queryA" TEMPLATE:7r54_B_1 identity=29.1% |
queryA 34:VADCSHLKLTQVPDDLPTNITVLNLTHNQLRRLPAANFTRYSQLTSLDVGFNTISKLEPELCQKLPMLKVLNLQHNELSQLSDKTFAFCTNLTELHLMSN: 133 : * ** * ** * * * * * ** * * * * * ** ** * *: 7r54_B_1 20:IAECSNRRLQEVPQTVGKYVTELDLSDNFITHITNESFQGLQNLTKINLNHN------PNXXXXXXXXXXXXXGLN----ITDGAFLNLKNLRELLLEDN: 109 SecStr :EEE SS SS S S TT SEEE SS EE TTTTTT TT EEE S ------ ------------- E----E TTSSTT TT EEE SS: ExpBur :bbebeebebeebbeebbeebbebebbebebeebeeebbeebeebeebbbbeb------ee-------------ebe----beebbbeebeebeebbbbeb: queryA 134:SIQKIKNNPFVKQKNLITLDLSHNGLSSTKLGTQVQLENLQELLLSNNKIQALKSEELDIFANSSLKKLELSSNQIKEFSPGCFHAIGR---LFGLFLNN: 230 : * * * * * * * ** * * * * * * * * * : 7r54_B_1 110:QLPQI---PSGLPESLTELSLIQNNIYNITKEGISRLINLKNLYLAWNCYXXXXCEKTNI-------------------EDGVFETLTNLELLSLSFNSL: 187 SecStr : SS --- SS TT SEEE SS EE TTTTTT TT EEE SS ---- S EE------------------- TTTTTT TT EEE SS : ExpBur :ebeeb---beebbebbbebbbbebebeebeeebbbebeebeebebbebbe----eeebeb-------------------bebbbeebeebebbbbbbbbb: queryA 231:VQLGPSLTEKLCLELANTSIRNLSLSNSQLSTTSNTTFLGLKWTNLTMLDLSYN------------------NLNVVGNDSFAW--LPQLEYFFLEYNNI: 310 : * * * * * *** * * * ** *** **** * * * ** * ** * * : 7r54_B_1 188:SHVPPKLP---------SSLRKLFLSNTQIKYISEEDFKGL--INLTLLDLSGNCPRCFNAPFPCVPCDGGASINI---DRFAFQNLTQLRYLNLSSTSL: 273 SecStr :SS SS ---------TT EEE TT EE GGGGTT --TT EEE TTSS SS SS SSS EE--- TTTTTT TT EEE SS : ExpBur :eebbeebb---------eebeebebbbbebeebeeeebeeb--eebbbbbbbbbbbbeeeeebeeeebeeeeebeb---ebebbbebeebeebbbbbbbb: queryA 311:QHLFSHSLHGLFNVRYLNLKRSFTKQSIS----LASLPKID--DFSFQWLKC--LEHLNMEDNDIPGIKSNMFTGLINLKYLSLSNSFTSLRTLTNETFV: 402 : * * * * ** * ** * * * * * * * * * * * : 7r54_B_1 274:RKINAAWFKNMPHLKVLDLEFNYLVGEIASGAFLTMLPRLEILDLSFNYIKGSYPQHINISRN---------FSKLLSLRALHLRGYV--FQELREDDFQ: 362 SecStr :S GGGGTT TT EEE SS HHHHHH SGGGG TT EEE S TT SS GG---------GGG TT EEE TT -- SEE GGGGG: ExpBur :eebeeebbeebeebebbbbbbbebbebbeebebbeebeebeebbbbbbeeeeeeeeebebbee---------beebeebebbbbebbb--bbebeeebbe: Contact : b b bb b b queryA 403:SLAHSP-LHILNLTKNKISKIESDAFSWLGHLEVLDLGLNEIGQELTGQEWRGL----------------------ENIFEIY--------LSYNKYLQL: 471 : * * * ** * * * * ** * * * * * * * *: 7r54_B_1 363:PLMQLPNLSTINLGINFIKQIDFKLFQNFSNLEIIYLSENRISPLXXXXXXXXXXXXXXXXXXXXXXXXXXXXDPHSNFYHFTRPLIKPQCAAYGKALDL: 462 SecStr :GGTT SS EEE S SEE GGGGTT SS EEE SS ---------------------------- TTS SSS S SS HHHHTTSEEEE : ExpBur :bbbebeebebbbbbbbebeebebebbeebeebeebbbbebebebe----------------------------eeeeeebbbeeebbeeebeeeeebbbb: Contact : b b b queryA 472:TRNSFALVPSLQRLMLRRVALKNVDS-------SPSPFQPLRNLTILDLSNNNIANINDDMLEGLEKLEILDLQHNNLARLWKHANPGGPIYFLKGLSHL: 564 : ** * * * * * * *** ** * * * ** *** * * * *: 7r54_B_1 463:SLNSIFFIGPNQFENLPDIACLNLSANSNAQVLSGTEFSAIPHVKYLDLTNNRLDFDNASALTELSDLEVLDLSYN--SHYFRIAGVTHHLEFIQNFTNL: 560 SecStr : SSS SS TTTTTT EEEEE SS B S TTTTSTT EEE SS B STTTTTT TT EEE TT -- SS TTTSS GGGGG SS : ExpBur :bebebeebbeebbeebbebbbbbbbebebbbebebebbeebeebebbbbbebbbbbbeeebbbbbeebbbbbbbeb--ebeeeeeeebbbbebbeebeeb: queryA 565:HILNLESNGF-------------------------------DEIPVEVFKDLFELKIIDLGLNNLNTLPASVF-NNQVSLKSLNLQKNLITSVEKKVFGP: 632 : *** * * ** * * ** ** * * * * ** * * : 7r54_B_1 561:KVLNLSHNNIYTLTXKYNLESKSLVELVFSGNRLDILWXXXDNRYISIFKGLKNLTRLDLSLNRLKHIPNEAFLNLPASLTELHINDNMLKFFNWTLLQ-: 659 SecStr : EEE TT - S SS EEE TTS HHHH --- TTSTTTTTT TT EEE SS S HHHHHTS TT SEEE SS S GGGGG-: ExpBur :eebebbebebeebb-eeebebebbeebbbbebbbeebb---eeebbebbebbeebeebbbbebebeebeeebbebbbebbeebbbbebebeebebebbe-: queryA 633:AFRNLTELDMRFNPFDCTCESIAWFVNWINE---THTNIPELSS: 673 : * * ** * * * * * * * *: 7r54_B_1 660:QFPRLELLDLRGNKLLFLTDSLSDFTSSLRTLLLSHNRISHLPS: 703 SecStr :G TT EEE S S HHHH SS EEE SS : ExpBur :ebeebebbbbeebebeebbeeeeebbeebebbbbbebebeeebe: |