REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 09-MAR-09 3GK5 COMPND UNCHARACTERIZED RHODANESE-RELATED PROTEIN COMPND 3 TVG0868615; COMPND 4 CHAIN: A; COMPND 5 FRAGMENT: UNP RESIDUES 101-200; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA VOLCANIUM GSS1; SOURCE 3 ORGANISM_TAXID: 273116; SOURCE 4 STRAIN: GSS1 / DSM 4299 / IFO 15438 / JCM 9571; SOURCE 5 ATCC: 51530; SOURCE 6 GENE: TV0844, TVG0868615; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC; SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PET21 AUTHOR F.FOROUHAR,M.SU,J.SEETHARAMAN,L.MAO,R.XIAO,E.L.FOOTE, AUTHOR 2 C.CICCOSANTI,R.L.BELOTE,J.K.EVERETT,R.NAIR,T.B.ACTON,B.ROST, AUTHOR 3 G.T.MONTELIONE,L.TONG,J.F.HUNT,NORTHEAST STRUCTURAL AUTHOR 4 GENOMICS CONSORTIUM (NESG) >TYR.A 101 39.47 9.23 -12.07 39.28 6.60 -11.12 39.38 7.91 -11.60 3 0 1000.00 -999 ? >ARG.A 102 45.22 11.93 -11.52 48.05 12.12 -10.31 46.63 12.02 -10.92 2 0 1000.00 -999 ? >SER^A 103 44.44 5.21 -11.17 43.33 3.05 -11.20 43.88 4.13 -11.19 2 0 1000.00 -999 ? >ILE^A 104 48.21 3.77 -8.95 48.94 3.80 -7.66 48.58 3.78 -8.31 3 0 1000.00 -999 ? >ASN~A 105 48.94 -1.34 -11.15 48.72 -3.45 -11.17 48.83 -2.39 -11.16 2 0 1000.00 -999 ? >ALA~A 106 48.97 -2.55 -6.85 48.40 -3.89 -6.41 48.69 -3.22 -6.63 2 0 1000.00 -999 ? >ALA~A 107 52.41 -3.52 -8.12 52.69 -4.36 -9.36 52.55 -3.94 -8.74 2 0 1000.00 -999 ? >ASP~A 108 52.00 0.92 -10.01 52.10 0.37 -12.05 52.05 0.65 -11.03 2 0 1000.00 -999 ? >LEU~A 109 50.66 1.23 -4.98 50.06 2.43 -3.26 50.36 1.83 -4.12 3 0 1000.00 -999 ? >TYR~A 110 55.09 -3.32 -3.07 57.00 -4.71 -1.56 56.04 -4.01 -2.32 3 0 1000.00 -999 ? >GLU~A 111 57.24 -2.00 -7.97 56.79 -2.29 -10.01 57.02 -2.14 -8.99 2 0 1000.00 -999 ? >ASN~A 112 56.13 4.26 -6.52 57.07 3.93 -8.42 56.60 4.10 -7.47 2 0 1000.00 -999 ? >ILE.A 113 55.57 1.71 -1.02 56.38 2.02 0.25 55.98 1.86 -0.38 3 0 1000.00 -999 ? >LYS.A 114 57.72 5.73 -0.53 63.35 2.95 0.67 60.53 4.34 0.07 2 0 1000.00 -999 ? >ALA.A 115 56.50 8.19 -3.15 56.70 8.03 -4.65 56.60 8.11 -3.90 2 0 1000.00 -999 ? >TYR.A 116 51.94 6.86 -4.16 51.88 6.92 -6.95 51.91 6.89 -5.55 3 0 1000.00 -999 ? >THR^A 117 50.93 8.33 1.21 51.07 10.06 2.46 51.00 9.19 1.83 2 0 1000.00 -999 ? >VAL^A 118 48.21 5.70 1.30 48.32 3.54 1.23 48.26 4.62 1.26 3 0 1000.00 -999 ? >LEU^A 119 44.20 8.32 1.55 42.65 9.49 2.53 43.42 8.90 2.04 3 0 1000.00 -999 ? >ASP^A 120 42.98 3.37 4.64 41.85 1.59 4.66 42.42 2.48 4.65 2 0 1000.00 -999 ? >VAL.A 121 38.87 5.48 3.27 38.78 6.12 1.22 38.82 5.80 2.24 3 0 1000.00 -999 ? >ARG.A 122 39.06 -0.86 3.37 41.06 -2.58 4.92 40.06 -1.72 4.14 2 0 1000.00 -999 ? >GLU~A 123 33.12 2.18 7.61 33.03 4.29 7.79 33.08 3.23 7.70 2 0 1000.00 -999 ? >PRO~A 124 36.25 3.20 12.21 37.43 2.06 10.70 36.84 2.63 11.45 3 0 1000.00 -999 ? >PHE~A 125 34.46 -2.28 11.11 32.75 -2.53 8.89 33.60 -2.40 10.00 3 0 1000.00 -999 ? >GLU~A 126 36.05 -2.35 7.07 35.41 -1.43 5.28 35.73 -1.89 6.17 2 0 1000.00 -999 ? >LEU~A 127 42.15 -0.50 9.57 41.97 1.20 8.23 42.06 0.35 8.90 3 0 1000.00 -999 ? >ILE~A 128 40.97 -4.49 13.39 40.24 -4.98 13.50 40.60 -4.73 13.44 3 0 1000.00 -999 ? >PHE.A 129 39.65 -7.84 9.74 37.48 -8.52 11.38 38.56 -8.18 10.56 3 0 1000.00 -999 ? >GLY.A 130 45.02 -5.49 7.84 44.41 -4.95 7.88 44.72 -5.22 7.86 1 0 1000.00 -999 ? >SER.A 131 46.15 -2.24 6.28 46.58 -0.82 8.19 46.37 -1.53 7.23 2 0 1000.00 -999 ? >ILE.A 132 48.97 -0.11 2.96 49.22 -0.11 1.54 49.09 -0.11 2.25 3 0 1000.00 -999 ? >ALA.A 133 51.71 0.62 6.57 53.15 0.12 6.61 52.43 0.37 6.59 2 0 1000.00 -999 ? >ASN.A 134 52.93 4.84 7.05 54.64 4.01 8.03 53.78 4.43 7.54 2 0 1000.00 -999 ? >SER.A 135 48.31 4.68 5.68 46.71 2.83 5.84 47.51 3.76 5.76 2 0 1000.00 -999 ? >ILE^A 136 46.27 8.98 6.80 45.65 9.39 7.16 45.96 9.19 6.98 3 0 1000.00 -999 ? >ASN^A 137 42.33 5.39 8.93 40.37 4.56 8.75 41.35 4.98 8.84 2 0 1000.00 -999 ? >ILE.A 138 40.09 9.93 5.97 40.30 11.38 5.90 40.19 10.65 5.94 3 0 1000.00 -999 ? >PRO~A 139 36.63 6.33 8.64 36.96 7.24 6.64 36.80 6.79 7.64 3 0 1000.00 -999 ? >ILE~A 140 33.64 7.41 2.30 33.50 6.16 1.56 33.57 6.79 1.93 3 0 1000.00 -999 ? >SER~A 141 31.69 9.27 6.03 30.45 7.21 6.29 31.07 8.24 6.16 2 0 1000.00 -999 ? >GLU~A 142 34.36 10.36 9.47 35.63 9.73 11.03 34.99 10.04 10.25 2 0 1000.00 -999 ? >LEU~A 143 36.22 11.72 2.97 37.92 11.58 1.63 37.07 11.65 2.30 3 0 1000.00 -999 ? >ARG~A 144 30.46 16.88 2.68 32.01 19.15 1.37 31.23 18.01 2.02 2 0 1000.00 -999 ? >GLU~A 145 32.08 16.98 7.89 31.15 15.17 7.31 31.62 16.08 7.60 2 0 1000.00 -999 ? >LYS~A 146 38.03 16.14 7.38 38.39 12.70 12.20 38.21 14.42 9.79 2 0 1000.00 -999 ? >TRP~A 147 37.19 18.04 2.62 39.59 20.42 0.61 38.39 19.23 1.61 3 0 1000.00 -999 ? >LYS~A 148 41.23 19.58 4.96 39.63 22.52 7.98 40.43 21.05 6.47 2 0 1000.00 -999 ? >ILE~A 149 43.33 16.53 8.03 42.95 16.09 9.34 43.14 16.31 8.69 3 0 1000.00 -999 ? >LEU~A 150 44.44 15.88 2.62 43.22 14.15 3.06 43.83 15.01 2.84 3 0 1000.00 -999 ? >GLU.A 151 50.63 17.88 4.16 49.62 17.39 5.92 50.12 17.64 5.04 2 0 1000.00 -999 ? >ARG.A 152 47.97 22.96 -2.54 47.14 25.29 -4.34 47.55 24.12 -3.44 2 0 1000.00 -999 ? >ASP.A 153 53.42 19.50 -0.40 53.42 18.92 1.63 53.42 19.21 0.61 2 0 1000.00 -999 ? >LYS.A 154 51.71 15.05 -1.09 51.54 14.57 5.10 51.63 14.81 2.01 2 0 1000.00 -999 ? >LYS.A 155 50.87 12.34 -3.60 50.94 9.71 -8.47 50.90 11.02 -6.03 2 0 1000.00 -999 ? >TYR^A 156 47.15 11.87 -0.37 47.74 13.59 1.75 47.45 12.73 0.69 3 0 1000.00 -999 ? >ALA^A 157 46.99 6.74 -3.09 48.07 5.64 -3.06 47.53 6.19 -3.07 2 0 1000.00 -999 ? >VAL^A 158 43.33 6.23 -2.14 41.81 7.75 -2.25 42.57 6.99 -2.19 3 0 1000.00 -999 ? >ILE^A 159 43.64 1.87 -0.55 44.20 0.85 -0.06 43.92 1.36 -0.30 3 0 1000.00 -999 ? >CYH.A 160 39.32 0.90 -0.58 36.70 0.89 -1.26 38.01 0.90 -0.92 2 0 1000.00 -999 ? >ALA.A 161 38.20 -2.66 0.19 36.92 -3.13 0.92 37.56 -2.89 0.55 2 0 1000.00 -999 ? >HIS.A 162 35.77 -5.01 -2.67 35.18 -6.20 -1.05 35.48 -5.61 -1.86 3 0 1000.00 -999 ? >GLY~A 163 37.63 0.11 -5.10 36.92 -0.02 -4.79 37.28 0.04 -4.94 1 0 1000.00 -999 ? >ASN~A 164 32.84 0.38 -4.79 33.41 -1.31 -3.62 33.12 -0.47 -4.21 2 0 1000.00 -999 ? >ARG~A 165 33.30 2.10 1.00 34.83 0.06 2.73 34.06 1.08 1.86 2 0 1000.00 -999 ? >SER~A 166 37.96 4.90 -3.28 38.82 3.01 -4.50 38.39 3.95 -3.89 2 0 1000.00 -999 ? >ALA~A 167 36.74 5.83 -6.78 35.94 4.93 -7.70 36.34 5.38 -7.24 2 0 1000.00 -999 ? >ALA~A 168 34.15 8.20 -5.37 32.94 7.78 -4.57 33.54 7.99 -4.97 2 0 1000.00 -999 ? >ALA~A 169 36.72 9.78 -3.04 37.51 9.04 -1.97 37.12 9.41 -2.51 2 0 1000.00 -999 ? >VAL~A 170 39.13 10.45 -5.89 40.56 9.26 -6.96 39.85 9.85 -6.43 3 0 1000.00 -999 ? >GLU~A 171 35.20 11.47 -10.02 35.08 13.25 -11.16 35.14 12.36 -10.59 2 0 1000.00 -999 ? >PHE~A 172 35.05 14.96 -2.62 34.53 16.89 -0.65 34.79 15.92 -1.63 3 0 1000.00 -999 ? >LEU~A 173 40.38 14.40 -3.10 40.05 13.77 -1.07 40.21 14.08 -2.09 3 0 1000.00 -999 ? >SER~A 174 40.63 15.63 -7.55 39.02 14.83 -9.18 39.83 15.23 -8.36 2 0 1000.00 -999 ? >GLN~A 175 36.40 17.50 -9.16 34.26 17.42 -9.21 35.33 17.46 -9.18 2 0 1000.00 -999 ? >LEU.A 176 39.50 19.67 -3.57 37.59 19.65 -2.57 38.54 19.66 -3.07 3 0 1000.00 -999 ? >GLY.A 177 43.28 20.38 -6.47 43.07 19.83 -5.97 43.18 20.11 -6.22 1 0 1000.00 -999 ? >LEU.A 178 44.01 16.71 -3.48 44.06 17.22 -1.39 44.04 16.97 -2.43 3 0 1000.00 -999 ? >ASN.A 179 48.81 15.46 -6.08 50.02 14.16 -7.23 49.42 14.81 -6.66 2 0 1000.00 -999 ? >ILE^A 180 44.30 11.82 -4.53 43.56 13.02 -4.95 43.93 12.42 -4.74 3 0 1000.00 -999 ? >VAL^A 181 45.18 8.53 -7.35 47.29 8.18 -7.57 46.24 8.35 -7.46 3 0 1000.00 -999 ? >ASP^A 182 41.47 5.52 -7.88 40.10 4.04 -7.20 40.78 4.78 -7.54 2 0 1000.00 -999 ? >VAL^A 183 44.13 2.11 -6.21 45.50 1.59 -4.59 44.82 1.85 -5.40 3 0 1000.00 -999 ? >GLU.A 184 43.52 0.30 -10.71 44.86 0.03 -12.31 44.19 0.16 -11.51 2 0 1000.00 -999 ? >GLY~A 185 41.19 -3.65 -6.80 41.23 -2.96 -6.41 41.21 -3.30 -6.61 1 0 1000.00 -999 ? >GLY~A 186 41.26 -2.09 -3.35 41.87 -2.54 -3.71 41.57 -2.32 -3.53 1 0 1000.00 -999 ? >ILE~A 187 43.17 -3.22 0.95 43.28 -3.41 2.33 43.22 -3.31 1.64 3 0 1000.00 -999 ? >GLN~A 188 39.93 -8.47 -2.62 38.03 -8.65 -3.58 38.98 -8.56 -3.10 2 0 1000.00 -999 ? >SER~A 189 43.69 -6.98 -4.70 44.58 -6.11 -6.79 44.13 -6.54 -5.74 2 0 1000.00 -999 ? >TRP~A 190 48.06 -5.09 0.25 50.81 -2.53 -0.88 49.43 -3.81 -0.31 3 0 1000.00 -999 ? >ILE~A 191 45.41 -9.01 0.60 45.04 -9.19 2.00 45.22 -9.10 1.30 3 0 1000.00 -999 ? >GLU~A 192 43.04 -11.06 -3.74 42.43 -12.92 -2.94 42.74 -11.99 -3.34 2 0 1000.00 -999 ? >GLU~A 193 48.90 -9.07 -7.23 46.93 -8.82 -7.92 47.92 -8.95 -7.58 2 0 1000.00 -999 ? >GLY.A 194 50.73 -11.07 -1.82 50.62 -10.32 -2.11 50.67 -10.69 -1.96 1 0 1000.00 -999 ? >TYR.A 195 51.69 -6.38 -2.74 52.67 -6.21 -5.35 52.18 -6.30 -4.04 3 0 1000.00 -999 ? >PRO.A 196 54.25 -5.26 1.87 52.67 -6.77 2.28 53.46 -6.02 2.07 3 0 1000.00 -999 ? >VAL.A 197 49.92 -5.61 5.33 47.85 -6.32 5.44 48.88 -5.96 5.38 3 0 1000.00 -999 ? >VAL.A 198 49.99 -4.55 9.00 51.26 -2.97 9.80 50.62 -3.76 9.40 3 0 1000.00 -999 ? >LEU.A 199 48.25 -7.01 12.76 50.35 -6.62 13.23 49.30 -6.81 13.00 3 0 1000.00 -999 ? >GLU.A 200 48.86 -0.02 14.15 47.20 1.13 13.51 48.03 0.55 13.83 2 0 1000.00 -999 ?