REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-DEC-06 2OEB COMPND HYPOTHETICAL PROTEIN; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 OTHER_DETAILS: GENE PRODUCT AF_1862 FROM ARCHAEOGLOBUS FULGIDUS SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; SOURCE 3 ORGANISM_TAXID: 224325; SOURCE 4 STRAIN: DSM 4304; SOURCE 5 GENE: AF_1862; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PDM68 AUTHOR R.ZHANG,E.EVDOKIMOVA,O.KAGAN,A.SAVCHENKO,A.EDWARDS,A.JOACHIMIAK, AUTHOR 2 MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) >ASP~A 2 21.55 30.59 67.88 22.27 28.77 68.70 21.91 29.68 68.29 2 0 1000.00 -999 ? >ILE~A 3 16.78 29.91 65.54 16.17 29.55 65.15 16.47 29.73 65.35 3 0 1000.00 -999 ? >ARG~A 4 21.30 33.83 60.33 23.05 35.64 58.55 22.17 34.74 59.44 2 0 1000.00 -999 ? >GLU~A 5 23.92 29.09 64.10 25.51 30.28 64.94 24.72 29.68 64.52 2 0 1000.00 -999 ? >ILE~A 6 20.39 25.23 64.63 19.62 24.47 65.52 20.01 24.85 65.07 3 0 1000.00 -999 ? >GLU~A 7 16.05 26.95 61.33 14.62 25.45 60.81 15.33 26.20 61.07 2 0 1000.00 -999 ? >GLN~A 8 23.20 27.23 56.97 24.71 28.74 56.98 23.95 27.99 56.97 2 0 1000.00 -999 ? >GLU~A 9 24.52 23.97 60.94 26.24 23.97 59.72 25.38 23.97 60.33 2 0 1000.00 -999 ? >ARG~A 10 17.17 22.09 62.31 16.32 23.31 65.01 16.75 22.70 63.66 2 0 1000.00 -999 ? >ALA~A 11 18.67 22.17 55.73 18.48 23.61 55.21 18.58 22.89 55.47 2 0 1000.00 -999 ? >SER~A 12 22.21 21.21 54.61 24.63 21.20 54.62 23.42 21.20 54.61 2 0 1000.00 -999 ? >PHE~A 13 22.00 16.14 58.21 22.07 13.48 59.06 22.03 14.81 58.64 3 0 1000.00 -999 ? >ALA~A 14 18.54 17.02 55.00 17.22 17.82 55.28 17.88 17.42 55.14 2 0 1000.00 -999 ? >PHE~A 15 20.50 19.26 49.53 21.02 19.20 46.81 20.76 19.23 48.17 3 0 1000.00 -999 ? >LYS~A 16 22.69 15.66 51.79 26.74 14.82 56.21 24.72 15.24 54.00 2 0 1000.00 -999 ? >VAL~A 17 20.76 12.61 53.08 20.32 12.86 55.22 20.54 12.74 54.15 3 0 1000.00 -999 ? >VAL~A 18 17.77 12.92 50.71 15.81 13.85 50.87 16.79 13.39 50.79 3 0 1000.00 -999 ? >SER~A 19 20.19 13.51 47.77 20.78 15.86 47.58 20.48 14.68 47.67 2 0 1000.00 -999 ? >ASP~A 20 22.65 9.98 50.02 23.81 8.19 49.92 23.23 9.08 49.97 2 0 1000.00 -999 ? >ILE~A 21 17.43 8.61 49.42 17.13 7.37 50.16 17.28 7.99 49.79 3 0 1000.00 -999 ? >LYS~A 22 17.84 9.83 45.21 14.96 14.09 41.84 16.40 11.96 43.52 2 0 1000.00 -999 ? >ASP~A 23 22.67 9.73 44.40 24.46 9.06 43.43 23.57 9.40 43.91 2 0 1000.00 -999 ? >LYS~A 24 21.56 5.49 45.11 25.66 6.06 48.76 23.61 5.78 46.94 2 0 1000.00 -999 ? >TYR~A 25 17.86 3.45 46.29 19.31 1.74 47.91 18.59 2.59 47.10 3 0 1000.00 -999 ? >SER.A 26 17.44 6.89 41.09 19.22 6.27 39.56 18.33 6.58 40.32 2 0 1000.00 -999 ? >GLN.A 27 17.43 4.12 37.42 16.51 5.89 36.65 16.97 5.01 37.03 2 0 1000.00 -999 ? >ASN~A 28 14.85 1.74 43.41 13.74 0.36 44.60 14.30 1.05 44.01 2 0 1000.00 -999 ? >LYS~A 29 10.87 4.57 43.14 7.74 6.25 37.86 9.30 5.41 40.50 2 0 1000.00 -999 ? >LYS~A 30 9.72 2.10 45.81 10.45 -3.34 43.60 10.09 -0.62 44.71 2 0 1000.00 -999 ? >VAL~A 31 12.71 2.95 48.03 14.77 2.28 48.35 13.74 2.62 48.19 3 0 1000.00 -999 ? >GLN~A 32 13.55 7.42 45.37 13.62 8.61 43.57 13.59 8.01 44.47 2 0 1000.00 -999 ? >GLY~A 33 8.48 6.44 48.13 9.07 6.14 48.60 8.78 6.29 48.37 1 0 1000.00 -999 ? >LYS~A 34 8.82 4.37 51.29 5.36 -0.01 51.19 7.09 2.18 51.24 2 0 1000.00 -999 ? >TYR~A 35 13.73 7.95 52.91 15.27 9.68 54.48 14.50 8.82 53.69 3 0 1000.00 -999 ? >SER~A 36 9.29 9.67 51.97 9.81 10.49 49.77 9.55 10.08 50.87 2 0 1000.00 -999 ? >SER~A 37 6.34 7.96 53.71 4.95 6.81 52.07 5.65 7.39 52.89 2 0 1000.00 -999 ? >TYR~A 38 9.06 4.52 56.25 8.38 2.06 55.10 8.72 3.29 55.68 3 0 1000.00 -999 ? >ALA~A 39 9.86 10.44 57.18 10.66 11.20 56.14 10.26 10.82 56.66 2 0 1000.00 -999 ? >GLU~A 40 6.09 12.68 54.63 5.35 12.25 52.67 5.72 12.46 53.65 2 0 1000.00 -999 ? >LYS~A 41 4.89 9.46 59.58 1.32 5.79 56.35 3.10 7.62 57.97 2 0 1000.00 -999 ? >ALA~A 42 7.81 9.46 62.01 9.31 9.67 61.63 8.56 9.56 61.82 2 0 1000.00 -999 ? >PRO~A 43 7.32 13.86 62.02 6.94 12.16 63.39 7.13 13.01 62.71 3 0 1000.00 -999 ? >THR~A 44 3.42 11.05 64.94 1.46 10.99 64.01 2.44 11.02 64.48 2 0 1000.00 -999 ? >ILE~A 45 5.96 6.86 65.25 6.15 5.54 64.63 6.05 6.20 64.94 3 0 1000.00 -999 ? >ILE~A 46 8.61 10.91 67.53 9.90 11.40 67.23 9.26 11.16 67.38 3 0 1000.00 -999 ? >LEU~A 47 3.88 12.94 69.15 4.28 15.01 68.65 4.08 13.98 68.90 3 0 1000.00 -999 ? >ASN~A 48 1.80 8.33 69.77 0.30 9.74 69.22 1.05 9.04 69.50 2 0 1000.00 -999 ? >ASN~A 49 5.84 5.47 70.67 3.98 4.85 69.85 4.91 5.16 70.26 2 0 1000.00 -999 ? >GLY~A 50 8.84 8.61 72.33 8.68 8.26 71.59 8.76 8.43 71.96 1 0 1000.00 -999 ? >LEU~A 51 13.01 10.06 70.54 14.45 10.83 69.11 13.73 10.44 69.83 3 0 1000.00 -999 ? >GLY~A 52 13.65 5.95 71.93 12.92 5.99 71.49 13.28 5.97 71.71 1 0 1000.00 -999 ? >ALA~A 53 10.73 3.62 71.08 9.33 3.73 71.66 10.03 3.67 71.37 2 0 1000.00 -999 ? >THR~A 54 10.61 5.06 67.55 9.61 6.81 66.71 10.11 5.94 67.13 2 0 1000.00 -999 ? >LEU~A 55 15.49 4.94 67.64 16.39 6.85 67.14 15.94 5.89 67.39 3 0 1000.00 -999 ? >ALA~A 56 13.77 0.79 68.31 13.31 0.47 69.71 13.54 0.63 69.01 2 0 1000.00 -999 ? >PHE~A 57 8.67 1.49 64.76 6.98 1.38 62.53 7.83 1.43 63.65 3 0 1000.00 -999 ? >PHE~A 58 13.03 3.82 62.55 11.80 6.32 62.29 12.42 5.07 62.42 3 0 1000.00 -999 ? >LEU~A 59 16.19 -1.39 65.28 18.17 -0.50 65.38 17.18 -0.95 65.33 3 0 1000.00 -999 ? >SER~A 60 12.52 -3.93 64.70 10.32 -2.95 64.80 11.42 -3.44 64.75 2 0 1000.00 -999 ? >LYS~A 61 11.59 -3.74 60.99 6.13 -2.21 60.27 8.86 -2.98 60.63 2 0 1000.00 -999 ? >LEU.A 62 16.29 -4.01 60.14 16.63 -1.89 59.60 16.46 -2.95 59.87 3 0 1000.00 -999 ? >GLU.A 63 15.16 -8.77 56.25 14.24 -10.67 56.11 14.70 -9.72 56.18 2 0 1000.00 -999 ? >LYS.A 64 18.01 -10.03 61.25 15.14 -6.56 63.47 16.57 -8.30 62.36 2 0 1000.00 -999 ? >PRO.A 65 22.03 -12.52 61.79 20.30 -11.11 61.87 21.17 -11.82 61.83 3 0 1000.00 -999 ? >ILE.A 66 21.54 -6.03 62.48 20.82 -5.02 62.08 21.18 -5.53 62.28 3 0 1000.00 -999 ? >ASP.A 67 27.17 -6.45 62.40 27.01 -6.98 60.33 27.09 -6.71 61.36 2 0 1000.00 -999 ? >ASP.A 68 27.00 -3.36 65.27 27.47 -2.00 66.80 27.24 -2.68 66.04 2 0 1000.00 -999 ? >VAL.A 69 22.67 -1.61 65.62 21.14 -2.59 66.78 21.91 -2.10 66.20 3 0 1000.00 -999 ? >ASP~A 70 26.49 1.24 66.70 27.23 3.21 66.97 26.86 2.23 66.84 2 0 1000.00 -999 ? >TYR~A 71 24.46 6.18 64.32 26.40 8.02 65.03 25.43 7.10 64.68 3 0 1000.00 -999 ? >LYS~A 72 27.53 4.05 62.22 29.47 5.25 66.29 28.50 4.65 64.25 2 0 1000.00 -999 ? >SER~A 73 27.56 0.29 61.58 28.77 -0.39 63.52 28.17 -0.05 62.55 2 0 1000.00 -999 ? >ILE~A 74 22.94 0.97 60.16 21.75 -0.01 60.38 22.35 0.48 60.27 3 0 1000.00 -999 ? >ASN~A 75 25.34 -1.39 55.30 25.50 -1.18 53.15 25.42 -1.28 54.22 2 0 1000.00 -999 ? >PRO~A 76 21.46 2.84 55.50 21.68 0.68 54.95 21.57 1.76 55.22 3 0 1000.00 -999 ? >GLU~A 77 23.06 1.64 50.80 23.74 2.90 49.31 23.40 2.27 50.05 2 0 1000.00 -999 ? >SER~A 78 22.38 -4.14 52.45 22.51 -4.25 54.87 22.45 -4.19 53.66 2 0 1000.00 -999 ? >PHE~A 79 18.53 -3.85 55.53 19.83 -3.73 57.99 19.18 -3.79 56.76 3 0 1000.00 -999 ? >GLY.A 80 16.64 -6.84 50.72 16.16 -6.37 51.19 16.40 -6.60 50.96 1 0 1000.00 -999 ? >ASN~A 81 12.18 -5.59 50.67 11.66 -5.45 52.74 11.92 -5.52 51.71 2 0 1000.00 -999 ? >ALA~A 82 12.36 -1.28 49.81 11.32 -0.82 48.83 11.84 -1.05 49.32 2 0 1000.00 -999 ? >GLU~A 83 9.33 -1.94 55.24 7.42 -2.77 55.65 8.38 -2.35 55.44 2 0 1000.00 -999 ? >ASN~A 84 14.38 -3.72 55.06 13.26 -5.14 56.20 13.82 -4.43 55.63 2 0 1000.00 -999 ? >ILE~A 85 16.38 -0.17 51.61 17.01 -0.40 50.38 16.69 -0.28 50.99 3 0 1000.00 -999 ? >ALA~A 86 14.11 2.92 53.85 12.73 3.19 53.29 13.42 3.06 53.57 2 0 1000.00 -999 ? >TYR~A 87 11.52 1.26 58.37 8.78 1.61 58.67 10.15 1.43 58.52 3 0 1000.00 -999 ? >ALA~A 88 17.48 1.58 57.88 18.30 0.50 57.10 17.89 1.04 57.49 2 0 1000.00 -999 ? >PHE~A 89 18.71 5.04 53.64 20.53 4.46 51.58 19.62 4.75 52.61 3 0 1000.00 -999 ? >LEU~A 90 14.25 6.68 58.34 12.94 8.40 58.73 13.59 7.54 58.54 3 0 1000.00 -999 ? >TYR~A 91 18.21 3.36 62.97 19.82 2.68 65.14 19.02 3.02 64.06 3 0 1000.00 -999 ? >LYS~A 92 20.74 5.97 60.35 25.87 4.27 58.63 23.30 5.12 59.49 2 0 1000.00 -999 ? >HIS~A 93 19.38 9.52 56.81 19.76 8.91 54.85 19.57 9.22 55.83 3 0 1000.00 -999 ? >LEU~A 94 16.76 9.97 62.83 15.35 10.93 64.07 16.06 10.45 63.45 3 0 1000.00 -999 ? >SER~A 95 20.74 8.88 64.65 19.96 6.63 65.11 20.35 7.75 64.88 2 0 1000.00 -999 ? >THR~A 96 23.57 10.59 62.79 24.69 10.23 60.96 24.13 10.41 61.87 2 0 1000.00 -999 ? >TRP~A 97 19.43 16.32 63.98 21.59 18.91 61.97 20.51 17.62 62.98 3 0 1000.00 -999 ? >LEU~A 98 20.50 12.47 67.54 18.33 12.84 67.76 19.41 12.65 67.65 3 0 1000.00 -999 ? >ALA~A 99 24.99 12.15 67.59 25.33 10.68 67.42 25.16 11.41 67.51 2 0 1000.00 -999 ? >GLU~A 100 28.22 12.02 64.52 29.01 10.84 62.92 28.61 11.43 63.72 2 0 1000.00 -999 ? >GLY~A 101 24.88 16.96 63.65 25.36 16.35 63.29 25.12 16.65 63.47 1 0 1000.00 -999 ? >ASN.A 102 25.82 19.48 59.73 25.58 19.41 57.62 25.70 19.44 58.68 2 0 1000.00 -999 ? >GLY.A 103 29.88 17.43 61.50 29.52 17.95 61.99 29.70 17.69 61.75 1 0 1000.00 -999 ? >LYS.A 104 32.68 18.46 63.82 35.25 14.23 67.23 33.97 16.34 65.52 2 0 1000.00 -999 ? >ASP.A 105 33.42 21.07 59.87 35.01 22.04 58.89 34.21 21.55 59.38 2 0 1000.00 -999 ? >SER.A 106 29.82 22.81 61.68 28.15 21.17 62.20 28.98 21.99 61.94 2 0 1000.00 -999 ? >ALA.A 107 27.72 25.06 63.89 26.88 26.19 63.33 27.30 25.63 63.61 2 0 1000.00 -999 ? >PHE.A 108 23.59 20.98 65.84 22.18 19.08 67.33 22.88 20.03 66.58 3 0 1000.00 -999 ? >SER.A 109 27.76 18.78 66.05 29.12 19.33 67.99 28.44 19.05 67.02 2 0 1000.00 -999 ? >GLY.A 110 24.95 16.85 67.79 25.18 17.54 68.18 25.07 17.20 67.98 1 0 1000.00 -999 ? >LEU.A 111 21.86 16.48 71.34 20.51 18.19 71.10 21.19 17.34 71.22 3 0 1000.00 -999 ? >THR.A 112 24.72 13.07 72.33 23.72 11.73 70.97 24.22 12.40 71.65 2 0 1000.00 -999 ? >ASN.A 113 29.05 13.76 73.19 31.17 14.01 73.21 30.11 13.88 73.20 2 0 1000.00 -999 ? >GLY.A 114 28.65 10.55 69.50 28.20 10.55 70.14 28.43 10.55 69.82 1 0 1000.00 -999 ? >GLU.A 115 25.88 7.26 74.10 25.15 7.51 76.06 25.51 7.38 75.08 2 0 1000.00 -999 ? >ASP~A 116 24.27 4.49 70.14 22.58 3.81 69.07 23.43 4.15 69.61 2 0 1000.00 -999 ? >PRO~A 117 21.67 9.01 68.47 21.75 7.72 70.26 21.71 8.36 69.36 3 0 1000.00 -999 ? >LEU~A 118 18.70 3.84 70.64 16.90 2.63 70.64 17.80 3.23 70.64 3 0 1000.00 -999 ? >LYS~A 119 21.31 4.45 74.40 25.95 3.48 77.17 23.63 3.97 75.79 2 0 1000.00 -999 ? >TYR~A 120 21.91 10.68 74.74 21.57 13.41 75.44 21.74 12.04 75.09 3 0 1000.00 -999 ? >ILE~A 121 16.94 8.06 74.35 15.95 8.35 73.36 16.44 8.21 73.85 3 0 1000.00 -999 ? >MET~A 122 17.67 5.58 78.13 17.24 1.75 76.63 17.45 3.66 77.38 2 0 1000.00 -999 ? >GLU~A 123 22.10 5.82 79.64 23.91 5.67 78.52 23.01 5.75 79.08 2 0 1000.00 -999 ? >LYS~A 124 19.51 11.08 80.44 24.23 10.03 78.89 21.87 10.56 79.66 2 0 1000.00 -999 ? >THR~A 125 16.94 13.18 82.24 17.87 14.99 82.97 17.40 14.09 82.60 2 0 1000.00 -999 ? >ALA~A 126 13.37 13.41 80.94 12.07 13.41 81.78 12.72 13.41 81.36 2 0 1000.00 -999 ? >ILE~A 127 14.36 18.20 81.02 14.07 19.32 81.78 14.21 18.76 81.40 3 0 1000.00 -999 ? >ASP~A 128 18.56 15.63 78.60 19.71 17.09 79.60 19.13 16.36 79.10 2 0 1000.00 -999 ? >VAL~A 129 15.27 13.41 76.29 14.72 11.36 76.64 15.00 12.39 76.46 3 0 1000.00 -999 ? >ALA~A 130 12.55 15.97 75.45 11.69 16.70 76.46 12.12 16.34 75.96 2 0 1000.00 -999 ? >ILE~A 131 16.39 18.96 74.84 17.10 19.97 75.45 16.75 19.46 75.14 3 0 1000.00 -999 ? >SER~A 132 16.57 15.56 71.82 18.64 14.57 72.44 17.61 15.06 72.13 2 0 1000.00 -999 ? >THR~A 133 12.99 14.78 70.77 11.45 13.65 71.74 12.22 14.22 71.25 2 0 1000.00 -999 ? >GLU~A 134 12.21 20.92 69.86 12.67 22.72 70.87 12.44 21.82 70.36 2 0 1000.00 -999 ? >GLU~A 135 18.19 18.33 67.21 18.03 20.24 66.31 18.11 19.28 66.76 2 0 1000.00 -999 ? >ALA~A 136 14.63 14.87 66.06 14.18 13.61 66.84 14.41 14.24 66.45 2 0 1000.00 -999 ? >LEU~A 137 10.22 16.89 65.99 8.68 15.53 66.87 9.45 16.21 66.43 3 0 1000.00 -999 ? >SER~A 138 13.15 19.47 63.62 13.29 21.12 65.39 13.22 20.30 64.50 2 0 1000.00 -999 ? >ILE~A 139 16.73 16.59 61.74 17.25 16.49 61.14 16.99 16.54 61.44 3 0 1000.00 -999 ? >LEU~A 140 11.66 14.31 61.29 11.99 12.23 61.78 11.83 13.27 61.54 3 0 1000.00 -999 ? >ASN~A 141 10.16 19.41 60.04 8.61 20.43 59.05 9.38 19.92 59.54 2 0 1000.00 -999 ? >TRP~A 142 14.89 21.62 59.14 14.82 24.12 56.10 14.85 22.87 57.62 3 0 1000.00 -999 ? >ILE~A 143 14.20 14.40 56.51 14.96 13.25 56.87 14.58 13.83 56.69 3 0 1000.00 -999 ? >LYS~A 144 10.15 15.61 54.91 4.47 17.02 57.28 7.31 16.32 56.09 2 0 1000.00 -999 ? >LYS~A 145 10.36 18.92 53.02 11.29 23.96 56.20 10.83 21.44 54.61 2 0 1000.00 -999 ? >PHE~A 146 15.38 19.09 51.45 16.57 21.61 51.78 15.98 20.35 51.61 3 0 1000.00 -999 ? >ALA~A 147 11.73 14.36 50.33 11.24 13.32 51.34 11.48 13.84 50.84 2 0 1000.00 -999 ? >LYS~A 148 8.64 16.14 48.91 6.83 21.20 52.05 7.74 18.67 50.48 2 0 1000.00 -999 ? >ALA~A 149 10.99 18.36 46.77 12.02 19.36 47.31 11.50 18.86 47.04 2 0 1000.00 -999 ? >MET~A 150 13.27 15.54 45.51 16.78 16.90 47.42 15.03 16.22 46.47 2 0 1000.00 -999 ? >LEU~A 151 11.98 11.36 47.26 13.84 10.75 48.21 12.91 11.05 47.73 3 0 1000.00 -999 ? >GLU.A 152 9.71 9.21 41.98 8.14 9.37 40.54 8.92 9.29 41.26 2 0 1000.00 -999 ? >GLU.A 153 5.14 10.84 48.19 5.01 9.54 49.93 5.07 10.19 49.06 2 0 1000.00 -999 ?