REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-AUG-03 1QW2 COMPND CONSERVED HYPOTHETICAL PROTEIN TA1206; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; SOURCE 3 ORGANISM_TAXID: 2303; SOURCE 4 GENE: TA1206; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 6 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21-DE3; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PET15B AUTHOR A.SAVCHENKO,E.EVDOKIMOVA,M.KUDRYTSKA,A.E.EDWARDS,D.CHRISTENDAT, AUTHOR 2 MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) HET MSE A 21 8 HET MSE A 56 8 HET MSE A 62 8 HET MSE A 76 8 HET MSE A 84 8 >ASN.A 14 33.34 7.42 62.51 35.30 7.36 63.32 34.32 7.39 62.91 2 0 1000.00 -999 ? >TYR.A 15 30.18 10.41 59.57 31.37 12.92 59.17 30.78 11.66 59.37 3 0 1000.00 -999 ? >PHE.A 16 28.27 7.39 53.29 27.81 7.81 50.56 28.04 7.60 51.93 3 0 1000.00 -999 ? >GLN.A 17 27.77 14.24 53.82 28.95 15.97 53.42 28.36 15.11 53.62 2 0 1000.00 -999 ? >GLY.A 18 24.80 10.86 51.91 25.00 11.63 52.11 24.90 11.24 52.01 1 0 1000.00 -999 ? >HIS.A 19 21.62 15.67 50.48 21.02 17.31 49.33 21.32 16.49 49.91 3 0 1000.00 -999 ? >MET.A 20 24.95 17.91 52.15 26.60 20.41 50.34 25.77 19.16 51.25 2 0 1000.00 -999 ? >MET?A 21 23.25 21.29 52.06 19.14 20.34 51.55 21.19 20.81 51.81 2 0 1000.00 -999 ? >GLN.A 22 26.86 24.27 52.96 28.80 24.94 52.40 27.83 24.60 52.68 2 0 1000.00 -999 ? >ILE.A 23 20.67 27.45 54.02 19.34 27.04 53.94 20.00 27.24 53.98 3 0 1000.00 -999 ? >ASP.A 24 25.10 31.26 53.67 26.26 29.62 54.34 25.68 30.44 54.01 2 0 1000.00 -999 ? >SER.A 25 22.21 34.63 54.44 20.23 34.12 55.73 21.22 34.38 55.08 2 0 1000.00 -999 ? >ILE.A 26 25.64 36.62 51.90 25.98 35.73 50.81 25.81 36.17 51.36 3 0 1000.00 -999 ? >GLU.A 27 24.18 43.12 53.81 23.85 44.08 55.66 24.01 43.60 54.73 2 0 1000.00 -999 ? >ILE.A 28 26.22 41.86 48.40 26.94 41.01 47.49 26.58 41.43 47.95 3 0 1000.00 -999 ? >GLY.A 29 25.84 46.45 49.14 25.45 45.96 49.68 25.64 46.20 49.41 1 0 1000.00 -999 ? >GLY.A 30 23.34 46.63 51.98 23.30 46.08 51.41 23.32 46.36 51.70 1 0 1000.00 -999 ? >LYS^A 31 21.07 44.04 50.38 20.45 47.77 46.51 20.76 45.91 48.45 2 0 1000.00 -999 ? >VAL^A 32 20.26 40.57 51.72 19.47 40.19 53.71 19.87 40.38 52.72 3 0 1000.00 -999 ? >TYR^A 33 21.76 38.84 47.77 21.80 41.27 46.40 21.78 40.06 47.09 3 0 1000.00 -999 ? >GLN^A 34 17.72 33.93 51.10 18.34 33.88 53.14 18.03 33.91 52.12 2 0 1000.00 -999 ? >PHE^A 35 25.33 30.72 48.77 27.01 28.78 47.63 26.17 29.75 48.20 3 0 1000.00 -999 ? >PHE^A 36 20.23 26.07 48.41 19.50 23.38 48.60 19.86 24.73 48.50 3 0 1000.00 -999 ? >LYS^A 37 24.28 24.83 47.80 30.41 23.28 47.36 27.35 24.06 47.58 2 0 1000.00 -999 ? >SER^A 38 23.32 21.18 47.80 21.37 19.71 47.87 22.34 20.45 47.83 2 0 1000.00 -999 ? >ASP.A 39 24.92 16.64 47.07 26.55 16.80 48.40 25.74 16.72 47.74 2 0 1000.00 -999 ? >LEU.A 40 22.06 18.25 42.50 20.10 18.56 41.64 21.08 18.40 42.07 3 0 1000.00 -999 ? >GLY.A 41 24.19 15.00 40.76 24.72 15.50 41.21 24.46 15.25 40.98 1 0 1000.00 -999 ? >ASN.A 42 28.24 14.07 38.27 27.88 11.97 38.21 28.06 13.02 38.24 2 0 1000.00 -999 ? >ALA.A 43 27.81 18.49 39.96 27.59 19.29 38.69 27.70 18.89 39.33 2 0 1000.00 -999 ? >PRO.A 44 28.39 21.65 43.03 26.83 20.19 42.40 27.61 20.92 42.71 3 0 1000.00 -999 ? >LEU^A 45 21.96 22.22 42.92 20.11 23.32 43.24 21.03 22.77 43.08 3 0 1000.00 -999 ? >LEU^A 46 25.39 26.55 44.22 27.21 26.26 43.12 26.30 26.41 43.67 3 0 1000.00 -999 ? >PHE^A 47 19.73 29.03 44.28 17.89 28.42 46.32 18.81 28.72 45.30 3 0 1000.00 -999 ? >ILE^A 48 23.17 34.07 44.76 24.38 34.77 45.16 23.78 34.42 44.96 3 0 1000.00 -999 ? >LYS^A 49 18.56 34.62 45.38 13.15 35.38 47.56 15.86 35.00 46.47 2 0 1000.00 -999 ? >GLY.A 50 17.56 38.21 46.01 16.96 37.67 45.67 17.26 37.94 45.84 1 0 1000.00 -999 ? >SER.A 51 14.14 39.83 46.33 14.43 42.22 46.71 14.28 41.02 46.52 2 0 1000.00 -999 ? >LYS.A 52 14.00 40.65 42.61 15.04 46.91 42.89 14.52 43.78 42.75 2 0 1000.00 -999 ? >GLY.A 53 15.87 37.84 40.90 16.17 37.88 41.67 16.02 37.86 41.28 1 0 1000.00 -999 ? >TYR^A 54 16.87 33.16 40.43 15.44 32.12 38.25 16.15 32.64 39.34 3 0 1000.00 -999 ? >ALA^A 55 21.67 33.63 39.81 22.96 34.36 40.16 22.31 33.99 39.98 2 0 1000.00 -999 ? >MET?A 56 22.11 29.89 39.42 18.93 27.00 39.58 20.52 28.44 39.50 2 0 1000.00 -999 ? >CYH^A 57 24.74 27.39 38.29 23.99 25.00 39.55 24.36 26.19 38.92 2 0 1000.00 -999 ? >GLY^A 58 24.70 25.41 35.04 24.24 25.29 35.64 24.47 25.35 35.34 1 0 1000.00 -999 ? >TYR^A 59 22.34 21.33 37.62 23.77 18.95 38.03 23.05 20.14 37.83 3 0 1000.00 -999 ? >LEU^A 60 19.74 27.75 35.79 18.23 29.30 35.93 18.98 28.53 35.86 3 0 1000.00 -999 ? >ASN^A 61 16.04 25.08 32.30 15.29 24.74 30.34 15.66 24.91 31.32 2 0 1000.00 -999 ? >MET?A 62 17.17 29.60 31.00 17.72 32.91 31.43 17.45 31.25 31.21 2 0 1000.00 -999 ? >GLU^A 63 15.19 27.40 26.80 14.74 25.97 25.30 14.96 26.68 26.05 2 0 1000.00 -999 ? >THR^A 64 12.18 28.18 31.86 11.89 26.44 33.09 12.03 27.31 32.48 2 0 1000.00 -999 ? >SER^A 65 13.35 31.43 33.46 15.47 30.98 34.55 14.41 31.20 34.01 2 0 1000.00 -999 ? >ASN^A 66 12.92 33.21 28.93 14.78 34.22 28.74 13.85 33.72 28.84 2 0 1000.00 -999 ? >LYS^A 67 9.00 31.42 30.09 5.81 25.94 30.55 7.41 28.68 30.32 2 0 1000.00 -999 ? >VAL^A 68 7.90 32.58 33.54 8.54 30.98 34.89 8.22 31.78 34.21 3 0 1000.00 -999 ? >GLY^A 69 9.36 36.08 33.27 9.66 35.56 33.74 9.51 35.82 33.50 1 0 1000.00 -999 ? >ASP^A 70 12.80 34.54 36.35 11.49 33.19 37.28 12.15 33.87 36.82 2 0 1000.00 -999 ? >ILE^A 71 15.12 39.40 37.26 15.35 40.83 37.50 15.23 40.11 37.38 3 0 1000.00 -999 ? >ALA^A 72 17.69 35.46 36.16 16.99 34.12 35.99 17.34 34.79 36.07 2 0 1000.00 -999 ? >VAL^A 73 21.32 34.85 35.30 22.20 36.58 36.28 21.76 35.71 35.79 3 0 1000.00 -999 ? >ARG^A 74 22.22 28.47 32.44 24.07 26.61 30.85 23.15 27.54 31.64 2 0 1000.00 -999 ? >VAL^A 75 26.79 31.01 35.43 26.97 32.09 37.33 26.88 31.55 36.38 3 0 1000.00 -999 ? >MET?A 76 28.88 27.90 34.82 27.74 26.97 30.75 28.31 27.43 32.79 2 0 1000.00 -999 ? >GLY^A 77 31.78 26.00 36.37 31.26 26.45 36.77 31.52 26.23 36.57 1 0 1000.00 -999 ? >VAL^A 78 31.00 27.15 39.90 29.46 28.64 39.56 30.23 27.90 39.73 3 0 1000.00 -999 ? >LYS^A 79 31.20 25.18 43.14 35.43 21.13 40.66 33.31 23.15 41.90 2 0 1000.00 -999 ? >THR^A 80 31.24 27.91 45.79 33.37 27.93 46.11 32.31 27.92 45.95 2 0 1000.00 -999 ? >LEU^A 81 29.36 31.80 47.98 28.27 33.62 48.41 28.82 32.71 48.19 3 0 1000.00 -999 ? >ASP^A 82 34.38 32.59 46.47 34.54 33.37 48.42 34.46 32.98 47.44 2 0 1000.00 -999 ? >ASP^A 83 33.08 29.70 42.14 34.80 28.65 42.76 33.94 29.18 42.45 2 0 1000.00 -999 ? >MET?A 84 29.68 32.48 41.58 26.09 30.67 42.94 27.89 31.58 42.26 2 0 1000.00 -999 ? >LEU^A 85 30.74 36.61 43.88 29.26 37.03 45.40 30.00 36.82 44.64 3 0 1000.00 -999 ? >SER^A 86 33.56 36.06 40.35 35.21 36.07 42.14 34.38 36.06 41.24 2 0 1000.00 -999 ? >ALA^A 87 31.91 34.17 37.48 31.04 32.94 37.67 31.48 33.55 37.57 2 0 1000.00 -999 ? >LYS^A 88 30.75 35.81 34.28 35.11 38.64 33.14 32.93 37.23 33.71 2 0 1000.00 -999 ? >VAL^A 89 27.08 35.70 33.31 25.37 37.02 33.59 26.22 36.36 33.45 3 0 1000.00 -999 ? >VAL^A 90 26.71 33.14 30.51 27.57 31.15 30.38 27.14 32.14 30.45 3 0 1000.00 -999 ? >GLU^A 91 22.61 31.55 28.62 21.35 29.88 28.43 21.98 30.72 28.53 2 0 1000.00 -999 ? >ALA^A 92 20.73 36.52 31.11 21.28 37.94 30.95 21.01 37.23 31.03 2 0 1000.00 -999 ? >SER^A 93 16.94 36.37 31.07 15.93 37.24 33.10 16.43 36.80 32.08 2 0 1000.00 -999 ? >GLN^A 94 13.89 37.51 27.18 12.10 37.06 26.14 13.00 37.28 26.66 2 0 1000.00 -999 ? >GLU^A 95 11.45 39.94 32.89 10.49 41.73 32.27 10.97 40.83 32.58 2 0 1000.00 -999 ? >ALA^A 96 17.43 40.71 33.40 18.30 39.48 33.65 17.87 40.10 33.53 2 0 1000.00 -999 ? >GLN^A 97 19.28 40.33 28.59 19.06 39.42 26.68 19.17 39.88 27.64 2 0 1000.00 -999 ? >LYS^A 98 15.92 44.92 30.50 10.04 44.58 30.54 12.98 44.75 30.52 2 0 1000.00 -999 ? >VAL^A 99 17.62 46.13 33.68 16.80 44.90 35.30 17.21 45.51 34.49 3 0 1000.00 -999 ? >GLY^A 100 21.05 46.18 32.07 20.83 45.50 32.28 20.94 45.84 32.18 1 0 1000.00 -999 ? >ILE^A 101 21.86 41.71 33.82 21.91 41.04 35.10 21.88 41.37 34.46 3 0 1000.00 -999 ? >ASN^A 102 24.57 42.01 28.75 22.97 43.22 28.05 23.77 42.62 28.40 2 0 1000.00 -999 ? >PRO^A 103 24.49 37.38 27.58 25.72 38.47 29.08 25.10 37.93 28.33 3 0 1000.00 -999 ? >GLY^A 104 29.81 38.70 30.02 29.26 38.79 30.63 29.53 38.74 30.33 1 0 1000.00 -999 ? >ASP^A 105 27.73 41.37 33.54 27.19 42.99 32.32 27.46 42.18 32.93 2 0 1000.00 -999 ? >VAL^A 106 30.80 39.58 36.33 32.85 39.75 37.03 31.82 39.66 36.68 3 0 1000.00 -999 ? >LEU^A 107 27.86 37.17 39.38 25.96 36.48 40.15 26.91 36.83 39.77 3 0 1000.00 -999 ? >ARG^A 108 30.48 40.88 44.61 30.06 43.56 46.04 30.27 42.22 45.32 2 0 1000.00 -999 ? >ASN^A 109 30.00 43.95 38.17 32.08 43.98 38.65 31.04 43.96 38.41 2 0 1000.00 -999 ? >VAL^A 110 25.43 43.23 38.79 25.60 42.30 36.82 25.52 42.77 37.80 3 0 1000.00 -999 ? >ILE^A 111 25.04 40.65 42.92 24.68 40.10 43.39 24.86 40.37 43.15 3 0 1000.00 -999 ? >ASP^A 112 23.37 45.92 43.07 23.63 46.55 41.07 23.50 46.23 42.07 2 0 1000.00 -999 ? >LYS^A 113 20.06 44.27 40.43 22.33 47.41 35.40 21.20 45.84 37.92 2 0 1000.00 -999 ? >LEU^A 114 19.74 39.69 41.81 20.35 38.71 39.99 20.04 39.20 40.90 3 0 1000.00 -999 ? >GLY^A 115 18.00 42.36 45.24 17.69 42.72 44.56 17.85 42.54 44.90 1 0 1000.00 -999 ?