REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 26-FEB-07 2EFV COMPND HYPOTHETICAL PROTEIN MJ0366; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII DSM SOURCE 3 2661; SOURCE 4 ORGANISM_TAXID: 243232; SOURCE 5 STRAIN: DSM2661; SOURCE 6 GENE: MJ0366; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)CODONPLUS-RIL-X; SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PET-21A AUTHOR T.S.KUMAREVEL,P.KARTHE,S.KURAMITSU,S.YOKOYAMA,RIKEN AUTHOR 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI) HET PO4 A 101 5 SITE 1 AC1 5 LYS A 52 ASN A 76 LEU A 77 HOH A 102 >PHE.A 6 6.82 31.27 1.97 8.16 29.78 0.00 7.49 30.52 0.98 3 0 25.18 -999 ? O4 PO4 A 101 >MET.A 7 3.04 33.28 -0.38 -0.19 33.19 0.19 1.42 33.23 -0.10 2 0 22.35 -999 ? O4 PO4 A 101 >LYS.A 8 4.78 34.59 -3.57 6.29 40.27 -3.23 5.54 37.43 -3.40 2 0 30.03 -999 ? O4 PO4 A 101 >GLU.A 9 4.98 30.34 -1.87 4.29 28.64 -0.79 4.63 29.49 -1.33 2 0 21.13 -999 ? O4 PO4 A 101 >LYS.A 10 6.92 31.09 -7.59 7.27 36.47 -7.01 7.09 33.78 -7.30 2 0 26.90 -999 ? O4 PO4 A 101 >LYS.A 11 5.61 27.55 -7.80 6.93 25.61 -1.91 6.27 26.58 -4.86 2 0 20.93 -999 ? O4 PO4 A 101 >ARG^A 12 5.96 24.60 -13.43 6.49 21.59 -13.73 6.22 23.10 -13.58 2 0 16.96 -999 ? O1 PO4 A 101 >ALA^A 13 0.22 24.28 -10.23 -0.99 25.18 -10.07 -0.38 24.73 -10.15 2 0 12.76 -999 ? O4 PO4 A 101 >THR^A 14 -0.14 21.19 -12.41 1.41 19.77 -12.91 0.63 20.48 -12.66 2 0 11.53 -999 ? O1 PO4 A 101 >PHE^A 15 -4.38 22.39 -13.20 -4.29 24.34 -11.21 -4.34 23.36 -12.20 3 0 9.39 -999 ? O2 PO4 A 101 >TYR^A 16 -3.43 15.62 -14.78 -0.88 15.16 -13.72 -2.16 15.39 -14.25 3 0 7.07 -999 ? O1 PO4 A 101 >LEU^A 17 -7.11 19.80 -19.20 -6.87 21.54 -17.94 -6.99 20.67 -18.57 3 0 8.40 -999 ? O2 PO4 A 101 >TYR.A 18 -11.75 17.40 -21.58 -13.57 19.44 -22.19 -12.66 18.42 -21.89 3 0 10.04 -999 ? O2 PO4 A 101 >LYS.A 19 -7.87 19.00 -23.95 -10.93 23.24 -26.05 -9.40 21.12 -25.00 2 0 15.40 -999 ? O2 PO4 A 101 >ASN.A 20 -3.23 19.28 -25.30 -1.18 19.74 -24.94 -2.20 19.51 -25.12 2 0 15.83 -999 ? O1 PO4 A 101 >ILE.A 21 -6.02 24.32 -22.99 -7.01 24.21 -21.95 -6.52 24.26 -22.47 3 0 13.51 -999 ? O2 PO4 A 101 >ASP~A 22 -1.71 27.26 -24.77 -3.13 28.78 -25.10 -2.42 28.02 -24.94 2 0 19.34 -999 ? O2 PO4 A 101 >GLY~A 23 -1.20 28.27 -20.51 -1.63 28.52 -21.13 -1.41 28.40 -20.82 1 0 17.24 -999 ? O2 PO4 A 101 >ARG~A 24 -3.27 33.42 -25.09 -2.90 31.30 -27.28 -3.08 32.36 -26.18 2 0 22.52 -999 ? O2 PO4 A 101 >LYS~A 25 -6.36 29.51 -21.80 -9.58 26.69 -25.93 -7.97 28.10 -23.86 2 0 17.16 -999 ? O2 PO4 A 101 >LEU~A 26 -4.26 26.81 -18.32 -4.10 25.40 -16.66 -4.18 26.10 -17.49 3 0 12.77 -999 ? O2 PO4 A 101 >ARG~A 27 -2.10 33.56 -16.27 0.44 32.02 -15.45 -0.83 32.79 -15.86 2 0 19.42 -999 ? O2 PO4 A 101 >TYR~A 28 -10.04 32.48 -20.03 -12.76 32.99 -20.48 -11.40 32.74 -20.25 3 0 18.30 -999 ? O2 PO4 A 101 >LEU~A 29 -9.98 27.88 -17.30 -10.78 26.99 -19.10 -10.38 27.43 -18.20 3 0 12.61 -999 ? O2 PO4 A 101 >LEU~A 30 -7.13 29.59 -13.13 -6.28 29.17 -11.18 -6.71 29.38 -12.15 3 0 13.65 -999 ? O2 PO4 A 101 >HIS~A 31 -7.51 34.64 -13.61 -5.57 34.92 -12.87 -6.54 34.78 -13.24 3 0 18.95 -999 ? O2 PO4 A 101 >LYS~A 32 -13.12 32.51 -14.44 -16.83 33.67 -17.63 -14.97 33.09 -16.04 2 0 19.26 -999 ? O2 PO4 A 101 >LEU~A 33 -12.59 29.24 -10.89 -12.60 27.23 -11.71 -12.59 28.23 -11.30 3 0 12.19 -999 ? O2 PO4 A 101 >GLU~A 34 -11.24 34.71 -9.29 -10.71 34.72 -7.24 -10.98 34.71 -8.26 2 0 19.14 -999 ? O2 PO4 A 101 >ASN~A 35 -17.47 34.93 -11.38 -16.51 36.81 -11.10 -16.99 35.87 -11.24 2 0 21.44 -999 ? O2 PO4 A 101 >VAL~A 36 -18.34 30.38 -10.05 -17.78 28.69 -11.31 -18.06 29.54 -10.68 3 0 15.36 -999 ? O2 PO4 A 101 >GLU.A 37 -21.66 31.93 -6.92 -20.29 32.49 -5.41 -20.97 32.21 -6.17 2 0 20.17 -999 ? O2 PO4 A 101 >ASN.A 38 -23.22 25.94 -7.92 -24.51 26.96 -9.26 -23.87 26.45 -8.59 2 0 17.90 -999 ? O2 PO4 A 101 >VAL.A 39 -21.45 23.51 -11.05 -19.56 22.58 -11.55 -20.51 23.05 -11.30 3 0 12.13 -999 ? O2 PO4 A 101 >ASP~A 40 -25.00 22.71 -14.22 -25.24 21.24 -15.70 -25.12 21.97 -14.96 2 0 15.92 -999 ? O2 PO4 A 101 >ILE~A 41 -26.23 17.63 -12.24 -25.73 16.98 -11.13 -25.98 17.31 -11.68 3 0 15.23 -999 ? O3 PO4 A 101 >ASP~A 42 -25.49 18.47 -17.55 -25.10 17.61 -19.45 -25.30 18.04 -18.50 2 0 16.31 -999 ? O2 PO4 A 101 >THR~A 43 -21.39 19.80 -16.66 -20.91 21.91 -16.79 -21.15 20.85 -16.72 2 0 12.66 -999 ? O2 PO4 A 101 >LEU~A 44 -20.60 17.80 -12.27 -19.60 17.36 -10.40 -20.10 17.58 -11.34 3 0 9.64 -999 ? O3 PO4 A 101 >ARG~A 45 -23.49 12.17 -16.81 -23.41 13.42 -19.61 -23.45 12.80 -18.21 2 0 14.92 -999 ? O3 PO4 A 101 >ARG~A 46 -21.43 17.75 -20.76 -23.17 16.93 -23.16 -22.30 17.34 -21.96 2 0 16.69 -999 ? O2 PO4 A 101 >ALA~A 47 -16.01 16.79 -16.76 -15.93 17.99 -15.80 -15.97 17.39 -16.28 2 0 6.68 -999 ? O2 PO4 A 101 >ILE~A 48 -16.80 13.15 -13.59 -17.14 12.74 -12.24 -16.97 12.95 -12.92 3 0 6.24 -999 ? O3 PO4 A 101 >GLU~A 49 -18.73 10.63 -17.19 -20.51 9.85 -18.02 -19.62 10.24 -17.60 2 0 12.39 -999 ? O3 PO4 A 101 >ALA~A 50 -13.85 13.10 -19.86 -13.77 14.61 -20.05 -13.81 13.85 -19.96 2 0 8.56 -999 ? O2 PO4 A 101 >GLU.A 51 -8.68 9.88 -21.01 -7.93 8.76 -22.65 -8.30 9.32 -21.83 2 0 12.05 -999 ? O1 PO4 A 101 >LYS.A 52 -8.17 14.11 -18.45 -12.24 13.47 -15.83 -10.20 13.79 -17.14 2 0 -4.77 -999 ? O3 PO4 A 101s >LYS.A 53 -4.84 13.03 -19.94 -6.08 10.72 -25.71 -5.46 11.87 -22.82 2 0 14.39 -999 ? O1 PO4 A 101 >TYR^A 54 -4.13 16.72 -23.14 -4.76 15.52 -25.58 -4.45 16.12 -24.36 3 0 13.12 -999 ? O1 PO4 A 101 >LYS^A 55 -0.77 17.64 -18.17 4.26 18.34 -17.37 1.75 17.99 -17.77 2 0 14.63 -999 ? O1 PO4 A 101 >ARG^A 56 -1.68 20.84 -20.96 0.58 21.82 -22.77 -0.55 21.33 -21.86 2 0 15.99 -999 ? O1 PO4 A 101 >SER^A 57 1.05 23.65 -15.68 2.24 21.65 -14.93 1.64 22.65 -15.30 2 0 13.47 -999 ? O1 PO4 A 101 >ILE^A 58 0.15 28.19 -15.11 -1.27 28.34 -15.39 -0.56 28.27 -15.25 3 0 15.84 -999 ? O2 PO4 A 101 >THR^A 59 3.63 29.22 -12.43 5.74 29.59 -12.43 4.68 29.41 -12.43 2 0 20.78 -999 ? O4 PO4 A 101 >LEU.A 60 0.54 30.42 -8.97 -0.75 28.70 -9.10 -0.11 29.56 -9.03 3 0 16.80 -999 ? O4 PO4 A 101 >THR~A 61 1.17 34.83 -9.37 -0.08 35.78 -10.85 0.54 35.30 -10.11 2 0 22.16 -999 ? O2 PO4 A 101 >GLU~A 62 0.63 37.03 -3.58 0.99 38.94 -2.74 0.81 37.98 -3.16 2 0 26.55 -999 ? O4 PO4 A 101 >GLU~A 63 -3.61 38.81 -7.55 -1.58 39.39 -7.48 -2.60 39.10 -7.51 2 0 25.11 -999 ? O4 PO4 A 101 >GLU~A 64 -3.09 33.49 -10.81 -1.96 33.16 -12.57 -2.53 33.33 -11.69 2 0 18.92 -999 ? O2 PO4 A 101 >GLU~A 65 0.55 31.81 -5.40 2.19 32.45 -4.21 1.37 32.13 -4.81 2 0 21.28 -999 ? O4 PO4 A 101 >VAL~A 66 -4.91 32.25 -3.18 -4.81 34.40 -2.81 -4.86 33.33 -3.00 3 0 19.56 -999 ? O4 PO4 A 101 >ILE~A 67 -7.50 31.35 -7.27 -8.14 31.90 -8.45 -7.82 31.62 -7.86 3 0 16.14 -999 ? O4 PO4 A 101 >ILE~A 68 -4.20 27.41 -6.18 -4.31 26.36 -7.19 -4.25 26.88 -6.69 3 0 12.83 -999 ? O4 PO4 A 101 >GLN~A 69 -3.36 28.52 -1.26 -2.24 29.94 -0.13 -2.80 29.23 -0.70 2 0 18.86 -999 ? O4 PO4 A 101 >ARG~A 70 -12.18 31.03 -2.73 -13.23 30.57 -5.59 -12.70 30.80 -4.16 2 0 15.94 -999 ? O4 PO4 A 101 >LEU~A 71 -10.02 25.77 -5.77 -11.19 26.97 -7.14 -10.61 26.37 -6.46 3 0 11.30 -999 ? O4 PO4 A 101 >GLY~A 72 -7.94 23.08 -2.78 -8.25 23.15 -3.56 -8.09 23.12 -3.17 1 0 10.52 -999 ? O4 PO4 A 101 >LYS.A 73 -8.39 19.61 -4.29 -6.09 15.29 -0.24 -7.24 17.45 -2.26 2 0 10.52 -999 ? O4 PO4 A 101 >SER~A 74 -11.45 20.69 -6.28 -12.41 22.76 -5.42 -11.93 21.73 -5.85 2 0 8.92 -999 ? O4 PO4 A 101 >ALA~A 75 -9.33 22.83 -8.61 -7.95 23.42 -8.29 -8.64 23.12 -8.45 2 0 8.06 -999 ? O4 PO4 A 101 >ASN~A 76 -7.79 18.93 -11.09 -7.03 18.20 -12.94 -7.41 18.56 -12.02 2 0 -4.01 -999 ? O2 PO4 A 101s >LEU~A 77 -13.01 18.32 -10.65 -14.66 17.03 -11.23 -13.83 17.67 -10.94 3 0 -3.88 -999 ? O2 PO4 A 101s >LEU~A 78 -13.41 23.63 -10.44 -14.97 23.78 -8.94 -14.19 23.71 -9.69 3 0 8.71 -999 ? O2 PO4 A 101 >LEU~A 79 -9.48 23.55 -14.24 -8.12 25.01 -13.44 -8.80 24.28 -13.84 3 0 8.32 -999 ? O2 PO4 A 101 >ASN~A 80 -12.10 19.34 -16.13 -10.16 18.61 -16.60 -11.13 18.98 -16.36 2 0 4.88 -999 ? O2 PO4 A 101 >CYH~A 81 -15.81 21.96 -15.72 -16.86 20.58 -13.49 -16.33 21.27 -14.61 2 0 7.78 -999 ? O2 PO4 A 101 >GLU~A 82 -14.32 27.25 -15.26 -16.19 28.18 -15.56 -15.25 27.71 -15.41 2 0 13.59 -999 ? O2 PO4 A 101 >LEU~A 83 -12.24 22.90 -20.06 -10.72 22.82 -21.58 -11.48 22.86 -20.82 3 0 10.80 -999 ? O2 PO4 A 101 >VAL~A 84 -16.64 22.11 -20.75 -17.66 20.33 -19.98 -17.15 21.22 -20.36 3 0 11.55 -999 ? O2 PO4 A 101 >LYS~A 85 -18.53 25.37 -20.30 -19.14 27.89 -14.97 -18.83 26.63 -17.63 2 0 14.72 -999 ? O2 PO4 A 101 >LEU~A 86 -14.54 27.26 -22.32 -13.20 28.73 -23.17 -13.87 28.00 -22.74 3 0 16.04 -999 ? O2 PO4 A 101 >ASP~A 87 -16.00 23.23 -25.25 -13.91 23.00 -25.04 -14.95 23.11 -25.15 2 0 14.79 -999 ? O2 PO4 A 101