REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-JUN-08 3DM8 COMPND UNCHARACTERIZED PROTEIN RPA4348; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; SOURCE 3 ORGANISM_TAXID: 1076; SOURCE 4 GENE: RPA4348; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21-CODONPLUS(DE3)-RP; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: P15TV LIC AUTHOR M.CYMBOROWSKI,M.CHRUSZCZ,T.SKARINA,O.KAGAN,A.SAVCHENKO,A.M.EDWARDS, AUTHOR 2 A.JOACHIMIAK,W.MINOR,MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) HET CE9 A 144 12 SITE 1 AC1 2 ASP A 34 GLN A 51 >MET.A 1 -21.93 30.07 41.67 -18.55 31.44 41.15 -20.24 30.75 41.41 2 0 24.98 -999 ? C36 CE9 A 144 >THR.A 2 -20.23 28.54 44.65 -21.92 27.26 45.03 -21.08 27.90 44.84 2 0 31.53 -999 ? C36 CE9 A 144 >GLU.A 3 -14.53 26.10 44.04 -13.30 24.55 43.25 -13.91 25.32 43.65 2 0 27.81 -999 ? C36 CE9 A 144 >HIS~A 4 -13.58 32.88 44.16 -12.99 34.78 43.49 -13.28 33.83 43.83 3 0 22.44 -999 ? C36 CE9 A 144 >SER~A 5 -12.04 30.75 40.40 -13.35 31.55 38.50 -12.69 31.15 39.45 2 0 20.36 -999 ? C36 CE9 A 144 >LEU~A 6 -9.21 32.45 43.97 -7.43 33.16 45.04 -8.32 32.81 44.50 3 0 21.32 -999 ? C33 CE9 A 144 >TRP~A 7 -12.17 28.95 46.52 -9.18 30.34 48.64 -10.68 29.64 47.58 3 0 26.30 -999 ? C33 CE9 A 144 >ARG~A 8 -13.08 26.53 39.07 -12.52 28.26 36.60 -12.80 27.40 37.83 2 0 21.36 -999 ? C36 CE9 A 144 >PHE~A 9 -5.04 30.43 39.45 -2.47 31.40 39.07 -3.76 30.91 39.26 3 0 17.88 -999 ? C33 CE9 A 144 >SER~A 10 -4.70 27.44 42.87 -4.07 27.43 45.21 -4.38 27.43 44.04 2 0 24.17 -999 ? C33 CE9 A 144 >ARG~A 11 -8.01 21.01 42.54 -10.42 22.86 42.59 -9.21 21.94 42.57 2 0 27.74 -999 ? C36 CE9 A 144 >ALA~A 12 -4.42 23.99 38.59 -5.09 24.94 37.60 -4.76 24.46 38.10 2 0 22.36 -999 ? C36 CE9 A 144 >LEU~A 13 -1.11 27.10 40.15 0.59 28.41 39.91 -0.26 27.76 40.03 3 0 20.48 -999 ? C33 CE9 A 144 >HIS~A 14 -0.85 21.52 44.07 -0.11 20.16 45.50 -0.48 20.84 44.79 3 0 28.85 -999 ? C33 CE9 A 144 >ARG~A 15 -4.21 18.91 38.58 -5.80 16.88 40.24 -5.01 17.90 39.41 2 0 30.78 -999 ? C36 CE9 A 144 >ALA~A 16 1.51 22.19 37.13 1.23 23.52 36.43 1.37 22.86 36.78 2 0 22.92 -999 ? O34 CE9 A 144 >LEU~A 17 4.17 24.14 40.69 4.27 26.26 40.11 4.22 25.20 40.40 3 0 23.19 -999 ? C33 CE9 A 144 >ASN~A 18 3.51 19.66 42.85 4.53 20.56 44.51 4.02 20.11 43.68 2 0 29.22 -999 ? C33 CE9 A 144 >ASP~A 19 1.75 16.58 39.24 1.29 16.06 41.22 1.52 16.32 40.23 2 0 31.56 -999 ? C33 CE9 A 144 >ARG~A 20 6.89 19.57 36.77 9.09 20.88 35.05 7.99 20.23 35.91 2 0 26.53 -999 ? C32 CE9 A 144 >GLN.A 21 0.07 16.02 35.54 -0.90 14.98 37.16 -0.42 15.50 36.35 2 0 31.23 -999 ? O34 CE9 A 144 >THR~A 22 -0.30 21.65 32.92 1.53 21.97 31.84 0.62 21.81 32.38 2 0 23.32 -999 ? O34 CE9 A 144 >GLU~A 23 -3.21 18.70 30.03 -1.53 17.96 31.21 -2.37 18.33 30.62 2 0 27.01 -999 ? C36 CE9 A 144 >GLU~A 24 -6.91 20.73 35.40 -7.25 20.11 37.43 -7.08 20.42 36.41 2 0 26.96 -999 ? C36 CE9 A 144 >LEU~A 25 -2.16 25.56 34.55 -1.08 27.20 35.44 -1.62 26.38 34.99 3 0 19.75 -999 ? O34 CE9 A 144 >ALA~A 26 -3.69 26.10 30.42 -3.12 25.16 29.35 -3.40 25.63 29.89 2 0 19.65 -999 ? C36 CE9 A 144 >THR~A 27 -7.50 25.99 30.46 -8.93 24.41 30.51 -8.21 25.20 30.48 2 0 21.55 -999 ? C36 CE9 A 144 >ILE~A 28 -7.62 28.21 34.67 -7.49 28.40 36.08 -7.55 28.31 35.37 3 0 18.91 -999 ? C36 CE9 A 144 >ILE^A 29 -3.72 30.84 31.73 -3.17 31.69 32.72 -3.44 31.27 32.22 3 0 14.27 -999 ? C36 CE9 A 144 >ASP^A 30 -7.36 35.06 29.87 -8.52 35.97 28.33 -7.94 35.51 29.10 2 0 10.74 -999 ? C36 CE9 A 144 >ASP^A 31 -5.90 33.79 24.74 -6.48 31.84 24.11 -6.19 32.81 24.43 2 0 13.95 -999 ? C36 CE9 A 144 >ASN^A 32 -5.36 38.57 26.01 -5.65 37.95 23.99 -5.51 38.26 25.00 2 0 8.21 -999 ? O37 CE9 A 144 >ILE^A 33 -3.21 36.22 31.23 -2.44 35.50 32.13 -2.82 35.86 31.68 3 0 9.78 -999 ? C36 CE9 A 144 >ASP^A 34 -2.72 41.84 31.88 -1.62 43.56 32.31 -2.17 42.70 32.09 2 0 -3.80 -999 ? C33 CE9 A 144s >TRP^A 35 3.31 37.02 34.88 1.50 34.01 36.58 2.41 35.52 35.73 3 0 11.76 -999 ? C33 CE9 A 144 >ALA^A 36 3.40 40.44 36.61 3.55 42.02 36.60 3.47 41.23 36.60 2 0 8.27 -999 ? C33 CE9 A 144 >ILE^A 37 5.92 37.65 39.58 5.94 36.31 40.06 5.93 36.98 39.82 3 0 14.22 -999 ? C32 CE9 A 144 >TYR^A 38 6.05 43.72 40.82 4.06 44.87 39.28 5.06 44.30 40.05 3 0 11.20 -999 ? C32 CE9 A 144 >GLY.A 39 11.12 40.52 41.68 11.12 40.77 40.88 11.12 40.64 41.28 1 0 16.23 -999 ? C32 CE9 A 144 >PRO.A 40 15.22 39.58 42.74 14.10 40.29 40.92 14.66 39.93 41.83 3 0 18.75 -999 ? C32 CE9 A 144 >ILE.A 41 14.35 39.54 35.81 13.77 40.49 34.94 14.06 40.01 35.37 3 0 14.73 -999 ? C32 CE9 A 144 >ASP.A 42 19.76 39.82 37.76 19.17 41.05 39.47 19.47 40.44 38.61 2 0 20.54 -999 ? C30 CE9 A 144 >MET.A 43 18.33 35.97 39.85 18.88 35.21 43.74 18.61 35.59 41.79 2 0 24.61 -999 ? C32 CE9 A 144 >PHE.A 44 14.35 34.47 41.29 15.29 33.96 43.86 14.82 34.22 42.57 3 0 21.78 -999 ? C32 CE9 A 144 >PRO.A 45 16.17 33.47 34.86 14.58 34.79 35.72 15.38 34.13 35.29 3 0 18.77 -999 ? C32 CE9 A 144 >PHE.A 46 10.97 32.13 37.18 11.93 31.40 39.66 11.45 31.77 38.42 3 0 19.21 -999 ? C32 CE9 A 144 >PHE.A 47 10.47 36.86 39.72 10.25 35.38 42.05 10.36 36.12 40.89 3 0 17.23 -999 ? C32 CE9 A 144 >GLY^A 48 8.57 40.25 35.69 8.07 39.68 35.77 8.32 39.97 35.73 1 0 10.71 -999 ? C32 CE9 A 144 >ALA^A 49 5.72 41.22 33.44 5.46 42.69 32.99 5.59 41.96 33.21 2 0 5.93 -999 ? C32 CE9 A 144 >ARG^A 50 6.86 37.11 30.66 9.28 37.16 32.55 8.07 37.13 31.60 2 0 11.79 -999 ? C32 CE9 A 144 >GLN^A 51 1.82 41.66 27.75 1.03 42.29 29.61 1.43 41.97 28.68 2 0 -3.15 -999 ? O34 CE9 A 144s >GLY~A 52 -0.52 36.21 27.02 -0.15 36.14 27.72 -0.33 36.17 27.37 1 0 8.71 -999 ? C36 CE9 A 144 >LYS~A 53 -1.05 32.63 27.99 -4.72 27.77 26.62 -2.89 30.20 27.31 2 0 17.12 -999 ? C36 CE9 A 144 >ALA~A 54 1.99 31.20 26.18 2.38 31.33 24.70 2.18 31.27 25.44 2 0 14.41 -999 ? O34 CE9 A 144 >ALA~A 55 4.42 33.48 28.03 4.57 35.01 27.84 4.50 34.24 27.94 2 0 11.08 -999 ? O34 CE9 A 144 >VAL~A 56 2.71 32.83 31.39 1.06 33.76 32.55 1.89 33.30 31.97 3 0 12.36 -999 ? O34 CE9 A 144 >LEU~A 57 2.16 28.22 29.77 0.12 27.42 29.97 1.14 27.82 29.87 3 0 17.27 -999 ? O34 CE9 A 144 >GLU~A 58 8.72 30.29 29.08 9.73 28.42 28.89 9.22 29.35 28.98 2 0 19.07 -999 ? C32 CE9 A 144 >VAL~A 59 6.99 31.30 33.52 6.52 33.27 34.41 6.76 32.29 33.96 3 0 15.06 -999 ? C32 CE9 A 144 >CYH~A 60 5.12 28.49 35.23 2.63 29.59 35.76 3.87 29.04 35.50 2 0 17.10 -999 ? C33 CE9 A 144 >ARG~A 61 8.83 24.61 30.08 11.61 25.64 30.74 10.22 25.13 30.41 2 0 22.41 -999 ? C32 CE9 A 144 >GLN~A 62 11.19 29.09 32.86 11.61 31.13 32.38 11.40 30.11 32.62 2 0 17.85 -999 ? C32 CE9 A 144 >ILE~A 63 7.81 28.54 38.76 7.14 29.54 39.49 7.48 29.04 39.13 3 0 20.15 -999 ? C32 CE9 A 144 >ALA~A 64 8.02 24.09 38.17 7.10 23.43 37.16 7.56 23.76 37.66 2 0 24.16 -999 ? C33 CE9 A 144 >ASP~A 65 12.27 23.76 35.88 11.85 22.77 34.10 12.06 23.27 34.99 2 0 25.51 -999 ? C32 CE9 A 144 >SER~A 66 13.09 25.22 39.90 13.58 27.20 38.60 13.34 26.21 39.25 2 0 23.81 -999 ? C32 CE9 A 144 >VAL^A 67 11.03 24.34 42.97 10.25 26.39 43.23 10.64 25.36 43.10 3 0 26.10 -999 ? C32 CE9 A 144 >ARG^A 68 8.53 18.05 45.36 6.34 16.61 43.75 7.44 17.33 44.55 2 0 32.60 -999 ? C33 CE9 A 144 >ILE^A 69 5.08 24.00 46.76 4.52 24.95 46.30 4.80 24.48 46.53 3 0 27.21 -999 ? C33 CE9 A 144 >TYR^A 70 7.73 21.21 51.81 9.27 22.71 53.50 8.50 21.96 52.65 3 0 33.79 -999 ? C33 CE9 A 144 >TYR^A 72 0.36 25.49 49.50 1.13 24.58 46.96 0.75 25.04 48.23 3 0 27.54 -999 ? C33 CE9 A 144 >HIS^A 73 -0.17 29.51 56.72 -1.31 30.45 58.21 -0.74 29.98 57.47 3 0 31.78 -999 ? C33 CE9 A 144 >ARG^A 74 -4.39 30.44 50.49 -4.20 30.61 47.44 -4.30 30.53 48.96 2 0 23.56 -999 ? C33 CE9 A 144 >GLU^A 75 -0.37 33.93 56.29 1.65 34.75 56.14 0.64 34.34 56.21 2 0 28.52 -999 ? C33 CE9 A 144 >SER^A 76 -5.51 36.42 54.42 -6.28 38.71 54.56 -5.90 37.57 54.49 2 0 26.59 -999 ? C33 CE9 A 144 >VAL^A 77 -8.02 36.06 51.64 -8.30 34.04 50.88 -8.16 35.05 51.26 3 0 25.41 -999 ? C33 CE9 A 144 >MET^A 78 -10.34 38.71 50.23 -8.75 42.02 52.36 -9.54 40.36 51.29 2 0 24.66 -999 ? C33 CE9 A 144 >LEU^A 79 -13.44 36.00 47.93 -12.56 34.09 47.76 -13.00 35.04 47.85 3 0 24.84 -999 ? C33 CE9 A 144 >GLY.A 80 -14.97 39.22 45.28 -14.70 38.44 45.05 -14.83 38.83 45.17 1 0 22.46 -999 ? C36 CE9 A 144 >ILE.A 81 -18.36 38.74 41.76 -19.80 38.78 41.52 -19.08 38.76 41.64 3 0 22.69 -999 ? C36 CE9 A 144 >ASP.A 82 -15.03 38.81 38.30 -16.74 37.89 37.39 -15.88 38.35 37.85 2 0 18.73 -999 ? C36 CE9 A 144 >SER^A 83 -11.58 39.03 41.71 -12.62 41.13 42.53 -12.10 40.08 42.12 2 0 18.53 -999 ? C36 CE9 A 144 >ALA^A 84 -9.51 38.17 44.73 -9.44 36.65 44.83 -9.47 37.41 44.78 2 0 20.08 -999 ? C33 CE9 A 144 >ALA^A 85 -6.58 39.25 46.89 -6.52 40.71 47.38 -6.55 39.98 47.14 2 0 19.56 -999 ? C33 CE9 A 144 >SER^A 86 -4.59 36.91 49.06 -4.38 34.51 49.49 -4.49 35.71 49.27 2 0 23.09 -999 ? C33 CE9 A 144 >MET^A 87 -1.58 36.58 51.22 0.73 38.71 52.64 -0.42 37.64 51.93 2 0 23.88 -999 ? C33 CE9 A 144 >VAL^A 88 0.06 33.16 51.28 -0.26 31.77 49.56 -0.10 32.47 50.42 3 0 24.42 -999 ? C33 CE9 A 144 >ARG^A 89 5.63 31.72 55.30 5.08 29.53 57.27 5.36 30.62 56.29 2 0 32.15 -999 ? C33 CE9 A 144 >TYR^A 90 4.26 28.87 47.79 2.42 28.81 45.68 3.34 28.84 46.73 3 0 23.94 -999 ? C33 CE9 A 144 >SER^A 91 7.40 26.34 51.88 6.60 26.32 54.16 7.00 26.33 53.02 2 0 31.63 -999 ? C33 CE9 A 144 >LEU^A 92 9.29 25.56 47.86 10.32 27.32 47.10 9.81 26.44 47.48 3 0 27.63 -999 ? C32 CE9 A 144 >THR^A 93 12.65 23.20 48.23 12.73 21.10 48.85 12.69 22.15 48.54 2 0 33.25 -999 ? C32 CE9 A 144 >ALA^A 94 14.89 24.18 45.39 15.98 25.18 45.59 15.43 24.68 45.49 2 0 29.74 -999 ? C32 CE9 A 144 >ALA.A 95 15.64 21.68 42.67 15.18 21.78 41.18 15.41 21.73 41.92 2 0 29.86 -999 ? C32 CE9 A 144 >GLY.A 96 19.04 20.04 42.73 18.72 20.32 43.40 18.88 20.18 43.07 1 0 33.69 -999 ? C32 CE9 A 144 >THR.A 97 20.46 21.88 45.67 20.43 23.97 45.16 20.44 22.93 45.41 2 0 32.68 -999 ? C32 CE9 A 144 >ASN.A 98 17.78 19.60 48.37 17.10 17.97 47.13 17.44 18.79 47.75 2 0 36.32 -999 ? C32 CE9 A 144 >ARG.A 99 19.11 26.50 50.96 20.58 27.67 53.36 19.84 27.09 52.16 2 0 35.37 -999 ? C32 CE9 A 144 >PRO^A 100 15.69 23.85 53.48 15.32 24.85 51.51 15.51 24.35 52.49 3 0 34.32 -999 ? C32 CE9 A 144 >ILE^A 101 13.31 28.80 49.60 13.94 29.57 48.61 13.62 29.18 49.11 3 0 28.31 -999 ? C32 CE9 A 144 >SER^A 102 9.95 30.02 52.50 8.61 30.78 54.42 9.28 30.40 53.46 2 0 29.85 -999 ? C33 CE9 A 144 >VAL^A 103 8.24 32.65 50.32 8.70 32.55 48.19 8.47 32.60 49.25 3 0 24.71 -999 ? C33 CE9 A 144 >ARG^A 104 4.49 37.28 54.38 5.32 35.71 56.90 4.90 36.49 55.64 2 0 29.26 -999 ? C33 CE9 A 144 >MET^A 105 3.52 36.53 48.66 4.28 33.35 46.05 3.90 34.94 47.36 2 0 20.67 -999 ? C33 CE9 A 144 >ALA^A 106 0.58 38.88 48.10 0.64 40.30 48.65 0.61 39.59 48.38 2 0 19.60 -999 ? C33 CE9 A 144 >LEU^A 107 -1.76 36.49 45.00 -2.03 35.20 43.37 -1.89 35.85 44.18 3 0 17.51 -999 ? C33 CE9 A 144 >PHE^A 108 -3.74 42.33 44.52 -3.21 43.51 46.95 -3.47 42.92 45.74 3 0 16.67 -999 ? C33 CE9 A 144 >THR^A 109 -6.22 38.39 40.64 -6.09 36.43 41.58 -6.15 37.41 41.11 2 0 16.26 -999 ? C33 CE9 A 144 >GLN^A 110 -8.48 41.82 38.19 -10.03 42.72 39.37 -9.25 42.27 38.78 2 0 14.25 -999 ? C36 CE9 A 144 >PHE^A 111 -10.62 35.01 38.08 -8.73 33.95 39.83 -9.68 34.48 38.96 3 0 17.00 -999 ? C36 CE9 A 144 >ASN.A 113 -15.54 34.07 30.80 -16.94 35.44 30.00 -16.24 34.75 30.40 2 0 17.47 -999 ? C36 CE9 A 144 >GLY.A 114 -13.79 31.73 34.72 -13.36 32.20 34.17 -13.57 31.96 34.45 1 0 18.74 -999 ? C36 CE9 A 144 >ARG^A 115 -10.38 31.52 29.53 -13.04 32.20 28.28 -11.71 31.86 28.90 2 0 16.48 -999 ? C36 CE9 A 144 >LEU^A 116 -6.30 33.71 35.57 -5.04 34.53 37.10 -5.67 34.12 36.34 3 0 14.16 -999 ? C36 CE9 A 144 >THR^A 117 -7.14 37.68 33.06 -9.21 38.24 32.88 -8.18 37.96 32.97 2 0 10.84 -999 ? C36 CE9 A 144 >ASN^A 118 -5.58 41.06 35.63 -4.11 42.60 35.88 -4.85 41.83 35.76 2 0 8.17 -999 ? C33 CE9 A 144 >LEU^A 119 -1.87 37.28 37.95 -0.47 36.07 39.21 -1.17 36.67 38.58 3 0 12.56 -999 ? C33 CE9 A 144 >ARG^A 120 0.44 43.27 38.28 -0.43 43.63 35.40 0.01 43.45 36.84 2 0 6.01 -999 ? C33 CE9 A 144 >MET^A 121 2.23 39.41 42.76 4.09 35.81 43.53 3.16 37.61 43.14 2 0 17.22 -999 ? C33 CE9 A 144 >VAL^A 122 4.42 41.14 45.33 4.13 43.21 45.97 4.27 42.18 45.65 3 0 16.70 -999 ? C33 CE9 A 144 >LEU^A 123 7.06 37.76 47.03 8.22 37.19 45.38 7.64 37.47 46.20 3 0 19.59 -999 ? C32 CE9 A 144 >ASP~A 124 9.19 39.14 51.68 10.77 39.90 52.95 9.98 39.52 52.31 2 0 25.83 -999 ? C32 CE9 A 144 >THR~A 125 12.12 39.51 47.62 11.43 40.87 46.12 11.78 40.19 46.87 2 0 19.85 -999 ? C32 CE9 A 144 >PHE~A 126 16.55 41.79 51.46 19.05 41.97 52.63 17.80 41.88 52.04 3 0 27.94 -999 ? C32 CE9 A 144 >ASP~A 127 12.91 37.37 53.08 13.08 35.86 54.49 12.99 36.61 53.79 2 0 29.20 -999 ? C32 CE9 A 144 >LEU~A 128 12.94 35.46 47.99 12.53 33.99 46.34 12.73 34.72 47.16 3 0 23.56 -999 ? C32 CE9 A 144 >VAL~A 129 17.26 36.30 47.80 18.13 37.88 46.47 17.70 37.09 47.13 3 0 25.29 -999 ? C32 CE9 A 144 >GLU~A 130 19.02 38.09 52.45 19.99 38.75 54.22 19.51 38.42 53.33 2 0 31.50 -999 ? C32 CE9 A 144 >GLN~A 131 15.40 32.48 53.06 13.34 31.92 52.97 14.37 32.20 53.02 2 0 29.64 -999 ? C32 CE9 A 144 >ALA~A 132 18.52 31.39 48.15 17.94 31.98 46.83 18.23 31.68 47.49 2 0 27.42 -999 ? C32 CE9 A 144 >LEU~A 133 22.56 34.15 48.47 22.83 35.59 46.83 22.69 34.87 47.65 3 0 29.74 -999 ? C32 CE9 A 144 >GLY~A 134 22.27 31.40 52.03 22.63 32.17 51.80 22.45 31.79 51.92 1 0 33.67 -999 ? C32 CE9 A 144 >ARG.A 135 27.92 33.42 52.26 29.41 33.69 54.92 28.66 33.55 53.59 2 0 39.42 -999 ? C32 CE9 A 144