Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b7397304067825b6e19e0d7cde28a9ac",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 39.322,
"b": 108.176,
"c": 30.227,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.956,1.478],
"number_observations_unique": 22364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 19.610
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.99
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.490],
"number_observations_unique": 1599,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.893
},
{
"type": "R(meas)",
"value": 0.932
},
{
"type": "I/SigI",
"value": 2.240
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.570,1.530],
"number_observations_unique": 1553,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.791
},
{
"type": "R(meas)",
"value": 0.827
},
{
"type": "I/SigI",
"value": 2.580
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.620,1.570],
"number_observations_unique": 1489,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.682
},
{
"type": "R(meas)",
"value": 0.710
},
{
"type": "I/SigI",
"value": 3.180
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.670,1.620],
"number_observations_unique": 1474,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.569
},
{
"type": "R(meas)",
"value": 0.592
},
{
"type": "I/SigI",
"value": 4.020
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.720,1.670],
"number_observations_unique": 1430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.474
},
{
"type": "R(meas)",
"value": 0.494
},
{
"type": "I/SigI",
"value": 4.810
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.780,1.720],
"number_observations_unique": 1377,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.405
},
{
"type": "R(meas)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 5.820
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.850,1.780],
"number_observations_unique": 1304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.316
},
{
"type": "R(meas)",
"value": 0.329
},
{
"type": "I/SigI",
"value": 7.660
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.920,1.850],
"number_observations_unique": 1282,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.241
},
{
"type": "R(meas)",
"value": 0.252
},
{
"type": "I/SigI",
"value": 9.710
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.010,1.920],
"number_observations_unique": 1247,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.190
},
{
"type": "R(meas)",
"value": 0.198
},
{
"type": "I/SigI",
"value": 12.790
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.110,2.010],
"number_observations_unique": 1177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "I/SigI",
"value": 16.820
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.220,2.110],
"number_observations_unique": 1127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 21.400
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.360,2.220],
"number_observations_unique": 1087,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 23.740
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.520,2.360],
"number_observations_unique": 1003,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 27.670
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.720,2.520],
"number_observations_unique": 940,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 31.740
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.980,2.720],
"number_observations_unique": 877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 41.220
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.330,2.980],
"number_observations_unique": 809,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 51.670
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.850,3.330],
"number_observations_unique": 715,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 66.890
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.710,3.850],
"number_observations_unique": 602,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 76.560
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [6.660,4.710],
"number_observations_unique": 498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 66.870
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [36.956,6.660],
"number_observations_unique": 297,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 84.470
},
{
"type": "Completeness",
"value": 99.700
}
]
}
]
}