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{ "schema": "picogpcr-template-v1", "id": "8F76_A_OR51E2", "source": "https://www.rcsb.org/structure/8F76", "source_ligand": "propionate", "residues": [ { "number": 4, "name": "CYS", "xyz": [ 14.161, 31.216, -0.659 ] }, { "number": 5, "name": "ASN", "xyz": [ 14.319, 33.197, 2.582 ] }, { "number": 6, "name": "PHE", "xyz": [ 12.422, 30.792, 4.863 ] }, { "number": 7, "name": "THR", "xyz": [ 10.865, 27.33, 4.95 ] }, { "number": 8, "name": "HIS", "xyz": [ 7.355, 26.474, 6.106 ] }, { "number": 9, "name": "ALA", "xyz": [ 7.418, 24.47, 9.338 ] }, { "number": 10, "name": "THR", "xyz": [ 3.724, 23.499, 9.187 ] }, { "number": 11, "name": "PHE", "xyz": [ 1.781, 22.064, 6.246 ] }, { "number": 12, "name": "VAL", "xyz": [ -1.997, 22.228, 5.837 ] }, { "number": 13, "name": "LEU", "xyz": [ -3.782, 19.143, 4.522 ] }, { "number": 14, "name": "ILE", "xyz": [ -6.877, 19.799, 2.43 ] }, { "number": 15, "name": "GLY", "xyz": [ -8.839, 16.568, 2.753 ] }, { "number": 16, "name": "ILE", "xyz": [ -11.723, 16.172, 0.307 ] }, { "number": 17, "name": "PRO", "xyz": [ -11.882, 19.275, -1.948 ] }, { "number": 18, "name": "GLY", "xyz": [ -15.485, 19.111, -3.133 ] }, { "number": 19, "name": "LEU", "xyz": [ -17.056, 17.901, 0.122 ] }, { "number": 20, "name": "GLU", "xyz": [ -16.205, 20.083, 3.125 ] }, { "number": 21, "name": "LYS", "xyz": [ -19.233, 20.494, 5.406 ] }, { "number": 22, "name": "ALA", "xyz": [ -20.039, 16.781, 5.837 ] }, { "number": 23, "name": "HIS", "xyz": [ -16.442, 15.799, 6.72 ] }, { "number": 24, "name": "PHE", "xyz": [ -17.601, 14.55, 10.13 ] }, { "number": 25, "name": "TRP", "xyz": [ -20.056, 12.366, 8.2 ] }, { "number": 26, "name": "VAL", "xyz": [ -17.032, 10.995, 6.337 ] }, { "number": 27, "name": "GLY", "xyz": [ -15.55, 10.547, 9.813 ] }, { "number": 28, "name": "PHE", "xyz": [ -18.206, 7.877, 10.466 ] }, { "number": 29, "name": "PRO", "xyz": [ -17.245, 4.981, 8.095 ] }, { "number": 30, "name": "LEU", "xyz": [ -13.44, 5.39, 8.065 ] }, { "number": 31, "name": "LEU", "xyz": [ -13.175, 4.964, 11.861 ] }, { "number": 32, "name": "SER", "xyz": [ -15.061, 1.684, 11.475 ] }, { "number": 33, "name": "MET", "xyz": [ -12.885, 0.988, 8.425 ] }, { "number": 34, "name": "TYR", "xyz": [ -9.822, 1.68, 10.596 ] }, { "number": 35, "name": "VAL", "xyz": [ -10.816, -0.828, 13.248 ] }, { "number": 36, "name": "VAL", "xyz": [ -11.648, -3.365, 10.522 ] }, { "number": 37, "name": "ALA", "xyz": [ -8.104, -2.879, 9.223 ] }, { "number": 38, "name": "MET", "xyz": [ -6.748, -3.251, 12.751 ] }, { "number": 39, "name": "PHE", "xyz": [ -8.831, -6.359, 13.376 ] }, { "number": 40, "name": "GLY", "xyz": [ -8.109, -7.637, 9.895 ] }, { "number": 41, "name": "ASN", "xyz": [ -4.426, -7.383, 10.59 ] }, { "number": 42, "name": "CYS", "xyz": [ -3.841, -7.879, 14.28 ] }, { "number": 43, "name": "ILE", "xyz": [ -5.826, -11.031, 15.059 ] }, { "number": 44, "name": "VAL", "xyz": [ -4.596, -12.362, 11.699 ] }, { "number": 45, "name": "VAL", "xyz": [ -1.015, -11.569, 12.748 ] }, { "number": 46, 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}, { "number": 91, "name": "ILE", "xyz": [ 1.022, 18.791, 10.38 ] }, { "number": 92, "name": "SER", "xyz": [ 4.567, 19.615, 11.464 ] }, { "number": 93, "name": "PHE", "xyz": [ 7.358, 19.388, 8.897 ] }, { "number": 94, "name": "GLU", "xyz": [ 9.327, 16.61, 10.618 ] }, { "number": 95, "name": "ALA", "xyz": [ 6.141, 14.574, 11.063 ] }, { "number": 96, "name": "CYS", "xyz": [ 5.276, 15.312, 7.422 ] }, { "number": 97, "name": "LEU", "xyz": [ 8.628, 13.91, 6.266 ] }, { "number": 98, "name": "THR", "xyz": [ 8.205, 10.947, 8.628 ] }, { "number": 99, "name": "GLN", "xyz": [ 4.743, 10.254, 7.179 ] }, { "number": 100, "name": "MET", "xyz": [ 6.071, 10.651, 3.611 ] }, { "number": 101, "name": "PHE", "xyz": [ 8.902, 8.16, 4.165 ] }, { "number": 102, "name": "PHE", "xyz": [ 6.81, 5.707, 6.153 ] }, { "number": 103, "name": "ILE", "xyz": [ 3.87, 5.472, 3.775 ] }, { "number": 104, "name": "HIS", "xyz": [ 6.133, 5.363, 0.682 ] }, { "number": 105, "name": "ALA", "xyz": [ 8.485, 2.793, 2.24 ] }, { 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}, { "number": 209, "name": "ASP", "xyz": [ 6.475, -5.644, -8.989 ] }, { "number": 210, "name": "VAL", "xyz": [ 3.129, -5.169, -10.755 ] }, { "number": 211, "name": "MET", "xyz": [ 4.359, -6.596, -14.085 ] }, { "number": 212, "name": "PHE", "xyz": [ 5.709, -9.676, -12.323 ] }, { "number": 213, "name": "ILE", "xyz": [ 2.54, -10.067, -10.207 ] }, { "number": 214, "name": "SER", "xyz": [ 0.424, -9.787, -13.371 ] }, { "number": 215, "name": "LEU", "xyz": [ 2.712, -12.295, -15.125 ] }, { "number": 216, "name": "SER", "xyz": [ 2.334, -14.67, -12.16 ] }, { "number": 217, "name": "TYR", "xyz": [ -1.449, -14.32, -12.206 ] }, { "number": 218, "name": "PHE", "xyz": [ -1.598, -14.756, -15.993 ] }, { "number": 219, "name": "LEU", "xyz": [ 0.456, -17.956, -15.751 ] }, { "number": 220, "name": "ILE", "xyz": [ -1.73, -19.15, -12.859 ] }, { "number": 221, "name": "ILE", "xyz": [ -4.84, -18.416, -14.968 ] }, { "number": 222, "name": "ARG", "xyz": [ -3.293, -20.327, -17.889 ] }, { "number": 223, "name": "THR", "xyz": [ -2.631, -23.244, -15.523 ] }, { "number": 224, "name": "VAL", "xyz": [ -6.121, -23.306, -13.976 ] }, { "number": 225, "name": "LEU", "xyz": [ -7.919, -22.956, -17.306 ] }, { "number": 226, "name": "GLN", "xyz": [ -6.531, -26.423, -18.131 ] }, { "number": 227, "name": "LEU", "xyz": [ -8.56, -28.056, -15.348 ] }, { "number": 228, "name": "PRO", "xyz": [ -10.961, -30.681, -16.758 ] }, { "number": 229, "name": "SER", "xyz": [ -14.019, -29.744, -14.677 ] }, { "number": 230, "name": "LYS", "xyz": [ -16.231, -26.723, -15.322 ] }, { "number": 231, "name": "SER", "xyz": [ -16.938, -25.779, -11.698 ] }, { "number": 232, "name": "GLU", "xyz": [ -13.367, -25.858, -10.36 ] }, { "number": 233, "name": "ARG", "xyz": [ -12.107, -23.927, -13.396 ] }, { "number": 234, "name": "ALA", "xyz": [ -14.865, -21.33, -12.915 ] }, { "number": 235, "name": "LYS", "xyz": [ -14.077, -20.988, -9.194 ] }, { "number": 236, "name": "ALA", "xyz": [ -10.332, -20.668, -9.853 ] }, { "number": 237, "name": 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-0.639, -7.922 ] }, { "number": 252, "name": "VAL", "xyz": [ -3.144, 1.39, -10.568 ] }, { "number": 253, "name": "PRO", "xyz": [ -4.043, 4.242, -8.126 ] }, { "number": 254, "name": "LEU", "xyz": [ -0.351, 4.268, -7.07 ] }, { "number": 255, "name": "ILE", "xyz": [ 1.185, 4.802, -10.513 ] }, { "number": 256, "name": "GLY", "xyz": [ -1.823, 6.927, -11.434 ] }, { "number": 257, "name": "LEU", "xyz": [ -1.134, 9.222, -8.47 ] }, { "number": 258, "name": "SER", "xyz": [ 2.498, 9.437, -9.579 ] }, { "number": 259, "name": "VAL", "xyz": [ 1.571, 10.362, -13.154 ] }, { "number": 260, "name": "VAL", "xyz": [ -1.162, 12.86, -12.175 ] }, { "number": 261, "name": "HIS", "xyz": [ 1.255, 14.596, -9.825 ] }, { "number": 262, "name": "ARG", "xyz": [ 4.051, 14.512, -12.409 ] }, { "number": 263, "name": "PHE", "xyz": [ 2.079, 15.236, -15.593 ] }, { "number": 264, "name": "GLY", "xyz": [ -1.692, 15.299, -15.076 ] }, { "number": 265, "name": "ASN", "xyz": [ -1.836, 18.427, -12.916 ] }, { "number": 266, "name": "SER", "xyz": [ -4.652, 19.961, -15.003 ] }, { "number": 267, "name": "LEU", "xyz": [ -7.198, 17.387, -13.807 ] }, { "number": 268, "name": "HIS", "xyz": [ -9.761, 18.019, -11.091 ] }, { "number": 269, "name": "PRO", "xyz": [ -8.439, 17.497, -7.532 ] }, { "number": 270, "name": "ILE", "xyz": [ -11.275, 15.096, -6.626 ] }, { "number": 271, "name": "VAL", "xyz": [ -10.072, 12.237, -8.869 ] }, { "number": 272, "name": "ARG", "xyz": [ -6.544, 12.587, -7.446 ] }, { "number": 273, "name": "VAL", "xyz": [ -7.92, 12.656, -3.882 ] }, { "number": 274, "name": "VAL", "xyz": [ -10.089, 9.554, -4.345 ] }, { "number": 275, "name": "MET", "xyz": [ -7.245, 7.833, -6.226 ] }, { "number": 276, "name": "GLY", "xyz": [ -4.867, 8.337, -3.322 ] }, { "number": 277, "name": "ASP", "xyz": [ -7.724, 7.33, -1.023 ] }, { "number": 278, "name": "ILE", "xyz": [ -8.21, 3.973, -2.76 ] }, { "number": 279, "name": "TYR", "xyz": [ -4.405, 3.701, -2.807 ] }, { "number": 280, "name": "LEU", "xyz": [ -3.934, 3.996, 0.971 ] }, { "number": 281, "name": "LEU", "xyz": [ -7.296, 3.521, 2.707 ] }, { "number": 282, "name": "LEU", "xyz": [ -8.596, 0.455, 0.815 ] }, { "number": 283, "name": "PRO", "xyz": [ -5.667, -2.099, 0.644 ] }, { "number": 284, "name": "PRO", "xyz": [ -5.431, -2.458, 4.474 ] }, { "number": 285, "name": "VAL", "xyz": [ -9.123, -3.472, 4.516 ] }, { "number": 286, "name": "ILE", "xyz": [ -9.332, -5.552, 1.316 ] }, { "number": 287, "name": "ASN", "xyz": [ -6.072, -7.454, 1.89 ] }, { "number": 288, "name": "PRO", "xyz": [ -7.5, -8.804, 5.193 ] }, { "number": 289, "name": "ILE", "xyz": [ -10.645, -9.929, 3.373 ] }, { "number": 290, "name": "ILE", "xyz": [ -9.388, -11.785, 0.298 ] }, { "number": 291, "name": "TYR", "xyz": [ -6.163, -13.109, 1.863 ] }, { "number": 292, "name": "GLY", "xyz": [ -6.964, -13.691, 5.537 ] }, { "number": 293, "name": "ALA", "xyz": [ -10.69, -14.4, 5.69 ] }, { "number": 294, "name": "LYS", "xyz": [ -10.69, -16.451, 2.475 ] }, { "number": 295, "name": "THR", "xyz": [ -8.163, -18.984, 3.805 ] }, { "number": 296, "name": "LYS", "xyz": [ -9.637, -21.971, 5.642 ] }, { "number": 297, "name": "GLN", "xyz": [ -6.935, -22.083, 8.329 ] }, { "number": 298, "name": "ILE", "xyz": [ -7.113, -18.423, 9.39 ] }, { "number": 299, "name": "ARG", "xyz": [ -10.931, -18.467, 9.233 ] }, { "number": 300, "name": "THR", "xyz": [ -11.123, -21.591, 11.406 ] }, { "number": 301, "name": "ARG", "xyz": [ -8.595, -20.09, 13.833 ] }, { "number": 302, "name": "VAL", "xyz": [ -10.552, -16.85, 14.205 ] }, { "number": 303, "name": "LEU", "xyz": [ -13.845, -18.765, 14.491 ] }, { "number": 304, "name": "ALA", "xyz": [ -12.301, -21.035, 17.136 ] }, { "number": 305, "name": "MET", "xyz": [ -11.225, -18.02, 19.206 ] } ], "helices": [ [ 24, 49 ], [ 60, 85 ], [ 94, 119 ], [ 140, 164 ], [ 192, 218 ], [ 237, 264 ], [ 270, 295 ] ], "ligand_anchor": [ 7.598549, 9.602085, -5.641168 ], "note": "Resolved CA reference, canonical residues 4-305. Rigid display transform from the previous viewer; not new predictions." }
{
"schema": "picogpcr-template-v1",
"id": "8F76_A_OR51E2",
"source": "https://www.rcsb.org/structure/8F76",
"source_ligand": "propionate",
"residues": [
{
"number": 4,
"name": "CYS",
"xyz": [
14.161,
31.216,
-0.659
]
},
{
"number": 5,
"name": "ASN",
"xyz": [
14.319,
33.197,
2.582
]
},
{
"number": 6,
"name": "PHE",
"xyz": [
12.422,
30.792,
4.863
]
},
{
"number": 7,
"name": "THR",
"xyz": [
10.865,
27.33,
4.95
]
},
{
"number": 8,
"name": "HIS",
"xyz": [
7.355,
26.474,
6.106
]
},
{
"number": 9,
"name": "ALA",
"xyz": [
7.418,
24.47,
9.338
]
},
{
"number": 10,
"name": "THR",
"xyz": [
3.724,
23.499,
9.187
]
},
{
"number": 11,
"name": "PHE",
"xyz": [
1.781,
22.064,
6.246
]
},
{
"number": 12,
"name": "VAL",
"xyz": [
-1.997,
22.228,
5.837
]
},
{
"number": 13,
"name": "LEU",
"xyz": [
-3.782,
19.143,
4.522
]
},
{
"number": 14,
"name": "ILE",
"xyz": [