################################################################################################ # Program: MUSTANG-Lite v0.1: A Multiple structural alignment algorithm # Authors: A. S. Konagurthu, A. M. Lesk, J. C. Whisstock, and P. J. Stuckey # Rundate: Sat Jul 23 13:41:04 2005 # Report_file: /mnt/EXTRA_STORAGE/MUSTANG_RESULTS/HOMSTRAD_Datasets/results/Cyclodex_gly_tran.html ################################################################################################ #==================================== # Aligned_structures: 6 # 1: 1cgt.pdb # 2: 1ciu.pdb # 3: 1cyg.pdb # 4: 1d3ca.pdb # 5: 1pama.pdb # 6: 1qhpa.pdb # # Length: 711 # Identity: 228/711 ( 32.1%) (Calculated as the percentage of conserved columns in the alignment.) # Similarity: 383/711 ( 53.9%) (Calculated as the percentage of semi-conserved columns in the alignment) # Gaps: 49/711 ( 6.9%) (Calculated as the percentage of columns with atleast one gap.) #===========================================ALIGNMENT START========================================= 1cgt.pdb 1 -DPDTA--VTNKQSFSTDVIYQVFTDRFLDGNPSNNP-T--GAAYDATCSNLKLYCGGDW 54 1ciu.pdb 1 -ASDTA--VSNVVNYSTDVIYQIVTDRFVDGNTSNNP-T--GDLYDPTHTSLKKYFGGDW 54 1cyg.pdb 1 ------AGNLNKVNFTSDVVYQIVVDRFVDGNTSNNP-S--GALFSSGCTNLRKYCGGDW 51 1d3ca.pdb 1 -APDTS--VSNKQNFSTDVIYQIFTDRFSDGNPANNP-T--GAAFDGTCTNLRLYCGGDW 54 1pama.pdb 1 -APDTS--VSNKQNFSTDVIYQIFTDRFSDGNPANNP-T--GAAFDGSCTNLRLYCGGDW 54 1qhpa.pdb 1 S---------SSASVKGDVIYQIIIDRFYDGDTTNNNPAKSYGLYDPTKSKWKMYWGGDL 51 n DViYQi DRF DGn NNp g d l Y GGDw 1cgt.pdb 55 QGLINKINDNYFSDLGVTALWISQPVENIFATINYSG-V-TNTAYHGYWARDFKKTNPYF 112 1ciu.pdb 55 QGIINKINDGYLTGMGVTAIWISQPVENIYAVLPD-STFGGSTSYHGYWARDFKRTNPYF 113 1cyg.pdb 52 QGIINKINDGYLTDMGVTAIWISQPVENVFSVMND-A-S-GSASYHGYWARDFKKPNPFF 108 1d3ca.pdb 55 QGIINKINDGYLTGMGVTAIWISQPVENIYSIINYSG-V-NNTAYHGYWARDFKKTNPAY 112 1pama.pdb 55 QGIINKINDGYLTGMGITAIWISQPVENIYSVINYSG-V-NNTAYHGYWARDFKKTNPAY 112 1qhpa.pdb 52 EGVRQKL--PYLKQLGVTTIWLSPVLDNLDTLAGT-----DNTGYHGYWTRDFKQIEEHF 104 qG inKi Yl GvTaiWiSqpveN t YHGYWaRDFK np 1cgt.pdb 113 GTMADFQNLITTAHAKGIKIVIDFAPNHTSPAMETDTSFAENGRLYDNGTLVGGYTND-T 171 1ciu.pdb 114 GSFTDFQNLINTAHAHNIKVIIDFAPNHTSPASETDPTYAENGRLYDNGTLLGGYTND-T 172 1cyg.pdb 109 GTLSDFQRLVDAAHAKGIKVIIDFAPNHTSPASETNPSYMENGRLYDNGTLLGGYTND-A 167 1d3ca.pdb 113 GTIADFQNLIAAAHAKNIKVIIDFAPNHTSPASSDQPSFAENGRLYDNGTLLGGYTND-T 171 1pama.pdb 113 GTMQDFKNLIDTAHAHNIKVIIDFAPNHTSPASSDDPSFAENGRLYDNGNLLGGYTND-T 171 1qhpa.pdb 105 GNWTTFDTLVNDAHQNGIKVIVDFVPNHSTPFKANDSTFAEGGALYNNGTYMGNYFDDAT 164 G dF L AHa IKviiDFaPNHtsPa aEnGrLYdNGtl GgYtnD t 1cgt.pdb 172 NGYFHHNGGS-DFSSLENGIYKNLY-----DLADFNHNNATIDKYFKDAIKLWLDMGVDG 225 1ciu.pdb 173 NGYFHHYGGT-DFSSYEDGIYRNLF-----DLADLNQQNSTIDSYLKSAIKVWLDMGIDG 226 1cyg.pdb 168 NMYFHHNGGT-TFSSLEDGIYRNLF-----DLADLNHQNPVIDRYLKDAVKMWIDMGIDG 221 1d3ca.pdb 172 QNLFHHNGGT-DFSTTENGIYKNLY-----DLADLNHNNSTVDVYLKDAIKMWLDLGIDG 225 1pama.pdb 172 QNLFHHYGGT-DFSTIENGIYKNLY-----DLADLNHNNSSVDVYLKDAIKMWLDLGVDG 225 1qhpa.pdb 165 KGYFHHNGDISNWDDRYEAQWKNFTDPAGFSLADLSQENGTIAQYLTDAAVQLVAHGADG 224 FHH Gg fs e giy Nl dLADln N d YlkdA k w d G DG 1cgt.pdb 226 IRVDAVKHMPLGWQKSWMSSIYAHKPVFTFGEWFL-GSAAS-DADNTDFANKSGMSLLDF 283 1ciu.pdb 227 IRLDAVKHMPFGWQKNFMDSILSYRPVFTFGEWFL-GTNEI-DVNNTYFANESGMSLLDF 284 1cyg.pdb 222 IRMDAVKHMPFGWQKSLMDEIDNYRPVFTFGEWFL-SENEV-DANNHYFANESGMSLLDF 279 1d3ca.pdb 226 IRMNAVKHMPFGWQKSFMAAVNNYKPVFTFGQWFL-GVNEV-SPENHKFANESGMSLLDF 283 1pama.pdb 226 IRVDAVKHMPFGWQKSFMATINNYKPVFTFGEWFL-GVNEI-SPEYHQFANESGMSLLDF 283 1qhpa.pdb 225 LRIDAVKHFNSGFSKSLADKLYQKKDIFLVGEWYGDDPGTANHLEKVRYANNSGVNVLDF 284 iR dAVKHmp GwqKs m pvFtfGeWfl fAN SGmslLDF 1cgt.pdb 284 RFNSAVRNVFRDNTSNMYALDSMINSTATDYNQVNDQVTFIDNHDMDRFKTSAVNNRRLE 343 1ciu.pdb 285 RFSQKVRQVFRDNTDTMYGLDSMIQSTASDYNFINDMVTFIDNHDMDRFYN-GGSTRPVE 343 1cyg.pdb 280 RFGQKLRQVLRNNSDNWYGFNQMIQDTASAYDEVLDQVTFIDNHDMDRFMIDGGDPRKVD 339 1d3ca.pdb 284 RFAQKVRQVFRDNTDNMYGLKAMLEGSAADYAQVDDQVTFIDNHDMERFHASNANRRKLE 343 1pama.pdb 284 RFAQKARQVFRDNTDNMYGLKAMLEGSEVDYAQVNDQVTFIDNHDMERFHTSNGDRRKLE 343 1qhpa.pdb 285 DLNTVIRNVFGTFTQTMYDLNNMVNQTGNEYKYKENLITFIDNHDMSRFLSVNSNKANLH 344 rf R Vfr nt mY l M Y d vTFIDNHDM RF r 1cgt.pdb 344 QALAFTLTSRGVPAIYYGTEQYLTGNGDPDNRAKMPSFSKSTTAFNVISKLAPLRKSNPA 403 1ciu.pdb 344 QALAFTLTSRGVPAIYYGTEQYMTGNGDPYNRAMMTSFNTSTTAYNVIKKLAPLRKSNPA 403 1cyg.pdb 340 MALAVLLTSRGVPNIYYGTEQYMTGNGDPNNRKMMSSFNKNTRAYQVIQKLSSLRRNNPA 399 1d3ca.pdb 344 QALAFTLTSRGVPAIYYGTEQYMSGGTDPDNRARIPSFSTSTTAYQVIQKLAPLRKCNPA 403 1pama.pdb 344 QALAFTLTSRGVPAIYYGSEQYMSGGNDPDNRARLPSFSTTTTAYQVIQKLAPLRKSNPA 403 1qhpa.pdb 345 QALAFILTSRGTPSIYYGTEQYMAGGNDPYNRGMMPAFDTTTTAFKEVSTLAGLRRNNAA 404 qALAf LTSRGvP IYYGtEQYm G DP NR sF TtA vi kLa LR NpA 1cgt.pdb 404 IAYGSTQQRWINNDVYVYERKFGKSVAVVAVNRNLSTSASITGLSTSLPTGSYTDVLGGV 463 1ciu.pdb 404 IAYGTTQQRWINNDVYIYERKFGNNVALVAINRNLSTSYNITGLYTALPAGTYTDVLGGL 463 1cyg.pdb 400 LAYGDTEQRWINGDVYVYERQFGKDVVLVAVNRSSSSNYSITGLFTALPAGTYTDQLGGL 459 1d3ca.pdb 404 IAYGSTQERWINNDVLIYERKFGSNVAVVAVNRNLNAPASISGLVTSLPQGSYNDVLGGL 463 1pama.pdb 404 IAYGSTHERWINNDVIIYERKFGNNVAVVAINRNMNTPASITGLVTSLPRGSYNDVLGGI 463 1qhpa.pdb 405 IQYGTTTQRWINNDVYIYERKFFNDVVLVAINRNTQSSYSISGLQTALPNGSYADYLSGL 464 iaYG T RWINnDV YERkFg V VA NRn sI GL T LP G Y D LgG 1cgt.pdb 464 LNGNNITSTN-GSINNFTLAAGATAVWQYTTAETTPTIGHVGPVMGKPGNVVTIDGRGFG 522 1ciu.pdb 464 LNGNSISVASDGSVTPFTLSAGEVAVWQYVSSSNSPLIGHVGPTMTKAGQTITIDGRGFG 523 1cyg.pdb 460 LDGNTIQVGSNGSVNAFDLGPGEVGVWAYSATESTPIIGHVGPMMGQVGHQVTIDGEGFG 519 1d3ca.pdb 464 LNGNTLSVGSGGAASNFTLAAGGTAVWQYTAATATPTIGHVGPMMAKPGVTITIDGRGFG 523 1pama.pdb 464 LNGNTLTVGAGGAASNFTLAPGGTAVWQYTTDATTPIIGNVGPMMAKPGVTITIDGRGFG 523 1qhpa.pdb 465 LGGNGISVSN-GSVASFTLAPGAVSVWQYSTSASAPQIGSVAPNMGIPGNVVTIDGKGFG 523 L GN v G FtL G VWqY P IG VgP M G TIDG GFG 1cgt.pdb 523 STKGTVYFGTTAVTGAAITSWEDTQIKVTIPSVAAGNYAVKVAA-SGVNSNAYNNFTILT 581 1ciu.pdb 524 TTSGQVLFGSTAG---TIVSWDDTEVKVKVPSVTPGKYNISLKTSSGATSNTYNNINILT 580 1cyg.pdb 520 TNTGTVKFGTTAA---NVVSWSNNQIVVAVPNVSPGKYNITVQSSSGQTSAAYDNFEVLT 576 1d3ca.pdb 524 SSKGTVYFGTTAVSGADITSWEDTQIKVKIPAVAGGNYNIKVANAAGTASNVYDNFEVLS 583 1pama.pdb 524 SGKGTVYFGTTAVTGADIVAWEDTQIQVKIPAVPGGIYDIRVANAAGAASNIYDNFEVLT 583 1qhpa.pdb 524 TTQGTVTFGGVTA---TVKSWTSNRIEVYVPNMAAGLTDVKVTAGG-VSS-NLYSYNILS 578 GtV FG ta sW i V P v G y v S y n L 1cgt.pdb 582 GDQVTVRFVVNNA-STTLGQNLYLTGNVAELGNWSTGS-----TAIGPAFNQVIHQYPTW 635 1ciu.pdb 581 GNQICVRFVVNNA-STVYGENVYLTGNVAELGNWDTS------KAIGPMFNQVVYQYPTW 633 1cyg.pdb 577 NDQVSVRFVVNNA-TTNLGQNIYIVGNVYELGNWDTS------KAIGPMFNQVVYSYPTW 629 1d3ca.pdb 584 GDQVSVRFVVNNA-TTALGQNVYLTGSVSELGNWDPA------KAIGPMYNQVVYQYPNW 636 1pama.pdb 584 GDQVTVRFVINNA-TTALGQNVFLTGNVSELGNWDPN------NAIGPMYNQVVYQYPTW 636 1qhpa.pdb 579 GTQTSVVFTVKSAPPTNLGDKIYLTGNIPELGNWSTDTSGAVNNAQGPLLAP---NYPDW 635 g Q VrFvvnnA T lG n yltGnv ELGNW AiGP nq YP W 1cgt.pdb 636 YYDVSVPAGKQLEFKFFKKN-GSTITWESGSNHTFTTPASGTATVTVNWQ- 684 1ciu.pdb 634 YYDVSVPAGTTIQFKFIKKN-GNTITWEGGSNHTYTVPSSSTGTVIVNWQQ 683 1cyg.pdb 630 YIDVSVPEGKTIEFKFIKKDSQGNVTWESGSNHVYTTPTNTTGKIIVDWQN 680 1d3ca.pdb 637 YYDVSVPAGKTIEFKFLKKQ-GSTVTWEGGSNHTFTAPSSGTATINVNWQP 686 1pama.pdb 637 YYDVSVPAGQTIEFKFLKKQ-GSTVTWEGGANRTFTTPTSGTATVNVNWQP 686 1qhpa.pdb 636 FYVFSVPAGKTIQFKFFIKRADGTIQWENGSNHVATTPTGATGNITVTWQN 686 yydvSVPaG ti FKF kK t tWE GsNh T P T V WQ #=========================================ALIGNMENT END============================================= #LEGEND: # # Colours indicate the chemical nature of the amino acid; # Red = small hydrophobic including aromatic,{A,F,I,L,M,P,V,W} # Blue = Acidic,{D,E} # Magenta = Basic,{K,R} and # Green = Basic amino acids with hydroxyl groups and/or amine groups {C,G,H,N,Q,S,T,Y}. # # The "markup row" below each stretch of the multiple alignment is used to mark completely conserved # residue (denoted in UPPERCASE) and semi-conserved reside ( denoted in lowercase) in a column of the alignment. # ################################################EOF#################################################