HEADER Ideal coordinates for PDB-CCD GTP COMPND GTP AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 PG GTP A 1 -6.030 -2.367 0.637 1.00 20.00 P HETATM 2 O1G GTP A 1 -7.326 -1.996 0.026 1.00 20.00 O HETATM 3 O2G GTP A 1 -6.285 -2.982 2.103 1.00 20.00 O HETATM 4 O3G GTP A 1 -5.296 -3.463 -0.286 1.00 20.00 O HETATM 5 O3B GTP A 1 -5.101 -1.058 0.758 1.00 20.00 O HETATM 6 PB GTP A 1 -4.818 0.206 -0.199 1.00 20.00 P HETATM 7 O1B GTP A 1 -4.732 -0.250 -1.605 1.00 20.00 O HETATM 8 O2B GTP A 1 -6.017 1.269 -0.052 1.00 20.00 O HETATM 9 O3A GTP A 1 -3.429 0.900 0.226 1.00 20.00 O HETATM 10 PA GTP A 1 -2.449 1.965 -0.479 1.00 20.00 P HETATM 11 O1A GTP A 1 -2.350 1.662 -1.925 1.00 20.00 O HETATM 12 O2A GTP A 1 -3.040 3.450 -0.282 1.00 20.00 O HETATM 13 O5' GTP A 1 -0.988 1.876 0.190 1.00 20.00 O HETATM 14 C5' GTP A 1 0.134 2.622 -0.287 1.00 20.00 C HETATM 15 C4' GTP A 1 1.360 2.304 0.570 1.00 20.00 C HETATM 16 O4' GTP A 1 1.749 0.933 0.378 1.00 20.00 O HETATM 17 C3' GTP A 1 2.548 3.182 0.132 1.00 20.00 C HETATM 18 O3' GTP A 1 2.994 3.997 1.218 1.00 20.00 O HETATM 19 C2' GTP A 1 3.645 2.166 -0.269 1.00 20.00 C HETATM 20 O2' GTP A 1 4.929 2.593 0.190 1.00 20.00 O HETATM 21 C1' GTP A 1 3.188 0.886 0.476 1.00 20.00 C HETATM 22 N9 GTP A 1 3.711 -0.311 -0.188 1.00 20.00 N HETATM 23 C8 GTP A 1 3.094 -1.021 -1.176 1.00 20.00 C HETATM 24 N7 GTP A 1 3.843 -2.023 -1.533 1.00 20.00 N HETATM 25 C5 GTP A 1 4.981 -2.017 -0.798 1.00 20.00 C HETATM 26 C6 GTP A 1 6.129 -2.842 -0.753 1.00 20.00 C HETATM 27 O6 GTP A 1 6.235 -3.807 -1.491 1.00 20.00 O HETATM 28 N1 GTP A 1 7.106 -2.535 0.129 1.00 20.00 N HETATM 29 C2 GTP A 1 6.978 -1.454 0.950 1.00 20.00 C HETATM 30 N2 GTP A 1 7.986 -1.165 1.835 1.00 20.00 N HETATM 31 N3 GTP A 1 5.916 -0.679 0.917 1.00 20.00 N HETATM 32 C4 GTP A 1 4.911 -0.918 0.066 1.00 20.00 C HETATM 33 HOG2 GTP A 1 -6.838 -3.775 2.106 1.00 20.00 H HETATM 34 HOG3 GTP A 1 -4.439 -3.753 0.055 1.00 20.00 H HETATM 35 HOB2 GTP A 1 -6.132 1.611 0.846 1.00 20.00 H HETATM 36 HOA2 GTP A 1 -3.133 3.717 0.643 1.00 20.00 H HETATM 37 H5' GTP A 1 0.335 2.352 -1.324 1.00 20.00 H HETATM 38 H5'' GTP A 1 -0.086 3.688 -0.226 1.00 20.00 H HETATM 39 H4' GTP A 1 1.133 2.480 1.621 1.00 20.00 H HETATM 40 H3' GTP A 1 2.270 3.803 -0.720 1.00 20.00 H HETATM 41 HO3' GTP A 1 3.741 4.571 0.998 1.00 20.00 H HETATM 42 H2' GTP A 1 3.652 2.007 -1.347 1.00 20.00 H HETATM 43 HO2' GTP A 1 5.218 3.438 -0.180 1.00 20.00 H HETATM 44 H1' GTP A 1 3.503 0.916 1.519 1.00 20.00 H HETATM 45 H8 GTP A 1 2.128 -0.786 -1.599 1.00 20.00 H HETATM 46 HN1 GTP A 1 7.903 -3.086 0.179 1.00 20.00 H HETATM 47 HN21 GTP A 1 8.776 -1.728 1.870 1.00 20.00 H HETATM 48 HN22 GTP A 1 7.909 -0.399 2.425 1.00 20.00 H CONECT 1 2 2 3 4 5 CONECT 3 33 CONECT 4 34 CONECT 5 6 CONECT 6 7 7 8 9 CONECT 8 35 CONECT 9 10 CONECT 10 11 11 12 13 CONECT 12 36 CONECT 13 14 CONECT 14 15 37 38 CONECT 15 16 17 39 CONECT 16 21 CONECT 17 18 19 40 CONECT 18 41 CONECT 19 20 21 42 CONECT 20 43 CONECT 21 22 44 CONECT 22 23 32 CONECT 23 24 24 45 CONECT 24 25 CONECT 25 26 32 32 CONECT 26 27 27 28 CONECT 28 29 46 CONECT 29 30 31 31 CONECT 30 47 48 CONECT 31 32 END