REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 15-NOV-04 1Y0N COMPND HYPOTHETICAL UPF0270 PROTEIN PA3463; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; SOURCE 3 ORGANISM_TAXID: 208964; SOURCE 4 STRAIN: PAO1; SOURCE 5 GENE: PA3463; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET15B AUTHOR T.A.BINKOWSKI,A.EDWARDS,A.SAVCHENKO,T.SKARINA,E.GORODICHTCHENSKAIA, AUTHOR 2 A.JOACHIMIAK,MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) HET GOL A 101 6 HET GOL A 104 6 HET GOL A 102 6 HET GOL A 103 6 SITE 1 AC1 6 ILE A 3 PRO A 4 HIS A 5 VAL A 51 SITE 1 AC2 5 GLU A 49 SER A 67 GOL A 102 HOH A 116 SITE 1 AC3 5 GLU A 49 ARG A 66 SER A 67 GOL A 104 SITE 1 AC4 6 HIS A 43 ARG A 47 PRO A 70 ALA A 71 >GLY.A -1 -22.36 -24.37 -6.60 -22.10 -24.16 -7.33 -22.23 -24.26 -6.96 1 0 12.79 -999 ? O2 GOL A 101 >HIS.A 0 -18.61 -24.77 -7.72 -17.14 -24.57 -9.20 -17.87 -24.67 -8.46 3 0 11.53 -999 ? O2 GOL A 101 >MET^A 1 -20.31 -28.59 -3.60 -20.65 -32.53 -4.88 -20.48 -30.56 -4.24 2 0 9.19 -999 ? O2 GOL A 101 >LEU^A 2 -17.82 -28.70 0.54 -17.30 -26.74 1.25 -17.56 -27.72 0.90 3 0 3.94 -999 ? O1 GOL A 101 >ILE.A 3 -15.46 -33.13 -2.31 -15.52 -33.15 -3.83 -15.49 -33.14 -3.07 3 0 -5.04 -999 ? O2 GOL A 101s >PRO~A 4 -14.97 -35.27 2.34 -14.01 -33.44 1.47 -14.49 -34.36 1.90 3 0 -4.30 -999 ? O2 GOL A 101s >HIS~A 5 -8.37 -32.78 2.94 -8.19 -32.97 5.02 -8.28 -32.87 3.98 3 0 -3.93 -999 ? O3 GOL A 101s >ASP~A 6 -9.37 -37.37 3.81 -11.15 -36.68 4.72 -10.26 -37.02 4.26 2 0 6.20 -999 ? O3 GOL A 101 >LEU~A 7 -13.28 -37.81 -0.23 -15.13 -38.83 -0.65 -14.20 -38.32 -0.44 3 0 8.11 -999 ? O2 GOL A 101 >LEU~A 8 -9.13 -35.75 -3.28 -10.31 -34.21 -4.27 -9.72 -34.98 -3.78 3 0 7.60 -999 ? O2 GOL A 101 >GLU~A 9 -7.05 -40.31 -7.63 -5.26 -39.49 -8.31 -6.16 -39.90 -7.97 2 0 15.38 -999 ? O2 GOL A 101 >ALA~A 10 -3.84 -38.30 -4.17 -2.79 -39.25 -3.53 -3.32 -38.77 -3.85 2 0 13.76 -999 ? O3 GOL A 101 >ASP~A 11 -2.25 -37.72 -8.80 -0.51 -38.95 -8.61 -1.38 -38.33 -8.70 2 0 17.80 -999 ? C3 GOL A 101 >THR~A 12 -5.55 -34.81 -8.23 -7.62 -35.70 -8.52 -6.59 -35.25 -8.38 2 0 12.29 -999 ? O2 GOL A 101 >LEU~A 13 -5.24 -34.07 -3.29 -5.63 -32.94 -1.38 -5.43 -33.51 -2.34 3 0 8.35 -999 ? C3 GOL A 101 >ASN~A 14 -0.30 -33.54 -5.65 -0.01 -35.01 -4.14 -0.15 -34.27 -4.89 2 0 14.08 -999 ? C3 GOL A 101 >ASN~A 15 -3.00 -31.46 -9.78 -1.85 -32.98 -10.82 -2.43 -32.22 -10.30 2 0 16.35 -999 ? C3 GOL A 101 >LEU~A 16 -6.34 -29.39 -6.01 -8.31 -30.07 -6.80 -7.32 -29.73 -6.41 3 0 9.36 -999 ? C3 GOL A 101 >LEU~A 17 -1.87 -28.78 -3.03 -2.55 -29.49 -1.11 -2.21 -29.13 -2.07 3 0 10.27 -999 ? C3 GOL A 101 >GLU~A 18 1.60 -26.93 -8.51 3.16 -28.08 -9.34 2.38 -27.51 -8.93 2 0 17.97 -999 ? O3 GOL A 103 >ASP~A 19 -4.00 -25.21 -9.02 -3.78 -26.48 -10.72 -3.89 -25.85 -9.87 2 0 15.25 -999 ? C3 GOL A 101 >PHE~A 20 -4.73 -22.91 -2.92 -5.33 -21.28 -0.69 -5.03 -22.09 -1.81 3 0 10.87 -999 ? C3 GOL A 101 >VAL~A 21 -0.37 -21.89 -4.04 0.68 -23.58 -3.00 0.16 -22.74 -3.52 3 0 11.83 -999 ? O3 GOL A 103 >THR~A 22 0.51 -20.48 -7.43 1.54 -22.07 -8.47 1.02 -21.28 -7.95 2 0 16.74 -999 ? O3 GOL A 103 >ARG~A 23 -5.15 -18.64 -4.74 -5.08 -17.87 -1.74 -5.11 -18.25 -3.24 2 0 11.20 -999 ? O1 GOL A 104 >GLU.A 31 9.00 -17.31 -3.90 7.56 -15.79 -4.26 8.28 -16.55 -4.08 2 0 16.14 -999 ? O3 GOL A 103 >THR.A 32 9.39 -19.79 -0.07 7.98 -19.89 1.55 8.68 -19.84 0.74 2 0 10.16 -999 ? O3 GOL A 103 >PRO~A 33 11.48 -23.67 -0.29 9.92 -22.53 -1.53 10.70 -23.10 -0.91 3 0 12.91 -999 ? O3 GOL A 103 >LEU~A 34 6.86 -25.39 -5.05 5.08 -25.47 -6.37 5.97 -25.43 -5.71 3 0 14.58 -999 ? O3 GOL A 103 >ASP~A 35 7.95 -28.74 -1.51 8.05 -29.80 0.27 8.00 -29.27 -0.62 2 0 11.07 -999 ? C3 GOL A 103 >VAL~A 36 6.79 -25.58 1.70 8.28 -24.43 2.81 7.53 -25.00 2.25 3 0 8.34 -999 ? C3 GOL A 103 >ARG~A 37 4.51 -20.47 -1.90 5.44 -20.77 -4.85 4.97 -20.62 -3.37 2 0 13.98 -999 ? O3 GOL A 103 >VAL~A 38 2.06 -26.80 -0.54 2.09 -28.27 -2.30 2.07 -27.54 -1.42 3 0 10.11 -999 ? C3 GOL A 103 >GLU~A 39 4.62 -29.75 3.28 3.50 -31.50 3.81 4.06 -30.63 3.55 2 0 7.59 -999 ? O2 GOL A 103 >ARG~A 40 3.24 -21.65 4.37 5.55 -19.64 4.30 4.39 -20.64 4.34 2 0 7.17 -999 ? O3 GOL A 103 >ALA~A 41 -1.85 -25.42 2.23 -1.84 -25.29 0.69 -1.84 -25.35 1.46 2 0 8.25 -999 ? O3 GOL A 103 >ARG~A 42 0.10 -32.08 2.17 -0.43 -33.48 -0.50 -0.17 -32.78 0.84 2 0 11.85 -999 ? O3 GOL A 101 >HIS~A 43 -1.26 -26.99 9.12 -1.39 -26.99 11.21 -1.33 -26.99 10.17 3 0 -3.35 -999 ? C2 GOL A 103s >ALA~A 44 -4.86 -25.28 6.07 -4.67 -24.22 5.02 -4.77 -24.75 5.54 2 0 6.79 -999 ? C3 GOL A 104 >LEU~A 45 -6.59 -29.13 3.41 -6.98 -29.03 1.39 -6.79 -29.08 2.40 3 0 4.96 -999 ? O3 GOL A 101 >ARG~A 46 -3.45 -32.64 8.18 -0.68 -31.54 7.33 -2.07 -32.09 7.75 2 0 5.81 -999 ? O2 GOL A 103 >ARG~A 47 -4.59 -24.97 11.06 -5.87 -23.81 13.62 -5.23 -24.39 12.34 2 0 -4.63 -999 ? O3 GOL A 104s >GLY.A 48 -10.61 -26.58 7.54 -10.01 -26.09 7.68 -10.31 -26.33 7.61 1 0 6.23 -999 ? O3 GOL A 101 >GLU.A 49 -8.67 -22.42 9.04 -7.13 -21.82 10.42 -7.90 -22.12 9.73 2 0 2.59 -999 ? O3 GOL A 104s >ALA^A 50 -9.07 -24.13 2.99 -7.68 -24.42 2.29 -8.38 -24.28 2.64 2 0 6.76 -999 ? C3 GOL A 101 >VAL^A 51 -11.73 -26.32 1.44 -13.52 -25.14 2.14 -12.63 -25.73 1.79 3 0 -3.75 -999 ? C2 GOL A 101s >ILE^A 52 -11.72 -29.39 -2.16 -10.76 -30.16 -2.56 -11.24 -29.77 -2.36 3 0 -3.96 -999 ? O2 GOL A 101s >LEU^A 53 -15.50 -25.59 -4.47 -16.68 -24.23 -3.23 -16.09 -24.91 -3.85 3 0 7.45 -999 ? O2 GOL A 101 >PHE^A 54 -16.88 -31.87 -7.42 -17.26 -33.60 -9.61 -17.07 -32.74 -8.52 3 0 10.11 -999 ? O2 GOL A 101 >ASP.A 55 -18.30 -27.66 -10.78 -19.90 -26.92 -12.04 -19.10 -27.29 -11.41 2 0 14.57 -999 ? O2 GOL A 101 >PRO.A 56 -22.46 -30.73 -9.07 -20.74 -31.03 -10.47 -21.60 -30.88 -9.77 3 0 13.13 -999 ? O2 GOL A 101 >GLU.A 57 -22.24 -28.07 -14.55 -23.73 -26.88 -15.55 -22.99 -27.48 -15.05 2 0 19.40 -999 ? O2 GOL A 101 >SER.A 58 -17.54 -29.57 -15.66 -17.08 -28.07 -13.77 -17.31 -28.82 -14.72 2 0 15.03 -999 ? O2 GOL A 101 >GLN.A 59 -17.76 -34.40 -13.79 -17.42 -36.30 -14.68 -17.59 -35.35 -14.23 2 0 16.92 -999 ? O2 GOL A 101 >GLN.A 60 -12.89 -28.56 -14.06 -11.93 -26.68 -14.63 -12.41 -27.62 -14.35 2 0 15.85 -999 ? O2 GOL A 101 >CYH^A 61 -12.45 -29.11 -8.51 -12.55 -31.65 -7.23 -12.50 -30.38 -7.87 2 0 8.12 -999 ? O2 GOL A 101 >GLN^A 62 -10.36 -23.64 -7.34 -10.71 -22.15 -8.76 -10.53 -22.89 -8.05 2 0 12.84 -999 ? O2 GOL A 101 >LEU^A 63 -7.57 -25.72 -3.38 -6.55 -26.99 -2.06 -7.06 -26.35 -2.72 3 0 7.40 -999 ? C3 GOL A 101 >MET^A 64 -10.24 -22.19 -1.99 -13.49 -20.77 -4.32 -11.86 -21.48 -3.16 2 0 10.52 -999 ? C2 GOL A 101 >LEU^A 65 -9.11 -19.00 1.57 -7.02 -18.60 2.09 -8.06 -18.80 1.83 3 0 6.85 -999 ? O1 GOL A 102 >ARG.A 66 -14.31 -21.81 7.01 -15.47 -24.64 6.71 -14.89 -23.22 6.86 2 0 -5.85 -999 ? O2 GOL A 102s >SER~A 67 -12.86 -16.99 3.79 -10.59 -16.16 3.48 -11.72 -16.57 3.63 2 0 4.62 -999 ? O1 GOL A 102s >GLU~A 68 -10.93 -15.79 -0.19 -9.23 -15.56 -1.37 -10.08 -15.68 -0.78 2 0 9.46 -999 ? O1 GOL A 102 >VAL~A 69 -16.24 -18.92 -0.24 -16.07 -21.13 -0.31 -16.15 -20.02 -0.27 3 0 8.33 -999 ? O1 GOL A 102 >PRO~A 70 -19.63 -17.28 -2.64 -19.16 -17.73 -0.43 -19.40 -17.51 -1.54 3 0 -11.03 -999 ? O1 GOL A 102s >ALA~A 71 -21.83 -18.59 2.80 -22.61 -17.70 3.83 -22.22 -18.14 3.31 2 0 -10.63 -999 ? O1 GOL A 102s >GLU~A 72 -26.12 -20.37 -1.39 -27.70 -20.65 0.03 -26.91 -20.51 -0.68 2 0 15.91 -999 ? O1 GOL A 101 >LEU~A 73 -20.53 -22.27 -1.74 -21.21 -21.78 -3.80 -20.87 -22.02 -2.77 3 0 11.31 -999 ? C1 GOL A 101 >LEU~A 74 -19.51 -22.46 3.79 -17.56 -21.64 3.54 -18.54 -22.05 3.67 3 0 7.82 -999 ? O1 GOL A 102 >ARG.A 75 -26.03 -23.23 6.05 -25.57 -23.67 9.08 -25.80 -23.45 7.56 2 0 13.56 -999 ? O1 GOL A 101 >ASP.A 76 -22.48 -27.74 1.71 -22.34 -29.19 0.14 -22.41 -28.46 0.92 2 0 7.84 -999 ? O1 GOL A 101