Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "23629e39743e52abe03041e1105e79a7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.69,
"b": 69.27,
"c": 154.06,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.032,2.800],
"number_observations": 624368,
"number_observations_unique": 12101,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "R(meas)",
"value": 0.181
},
{
"type": "I/SigI",
"value": 20.410
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 51.596
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.900,2.800],
"number_observations_unique": 1192,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.529
},
{
"type": "R(meas)",
"value": 3.561
},
{
"type": "I/SigI",
"value": 1.870
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 54.501
},
{
"type": "CC(1/2)",
"value": 0.691
}
]
},
{
"resolution_limits": [3.020,2.900],
"number_observations_unique": 1227,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.246
},
{
"type": "R(meas)",
"value": 2.268
},
{
"type": "I/SigI",
"value": 2.750
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 53.290
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
},
{
"resolution_limits": [3.150,3.020],
"number_observations_unique": 1130,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.412
},
{
"type": "R(meas)",
"value": 1.425
},
{
"type": "I/SigI",
"value": 4.760
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 54.220
},
{
"type": "CC(1/2)",
"value": 0.923
}
]
},
{
"resolution_limits": [3.320,3.150],
"number_observations_unique": 1204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.927
},
{
"type": "R(meas)",
"value": 0.936
},
{
"type": "I/SigI",
"value": 7.020
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 53.186
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
},
{
"resolution_limits": [3.530,3.320],
"number_observations_unique": 1201,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.562
},
{
"type": "R(meas)",
"value": 0.568
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 50.332
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [3.800,3.530],
"number_observations_unique": 1176,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.338
},
{
"type": "R(meas)",
"value": 0.342
},
{
"type": "I/SigI",
"value": 17.610
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 48.883
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
{
"resolution_limits": [4.180,3.800],
"number_observations_unique": 1193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.210
},
{
"type": "R(meas)",
"value": 0.212
},
{
"type": "I/SigI",
"value": 27.860
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 54.443
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.790,4.180],
"number_observations_unique": 1243,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 37.480
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 51.623
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.030,4.790],
"number_observations_unique": 1228,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.139
},
{
"type": "I/SigI",
"value": 40.320
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 50.547
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [42.032,6.030],
"number_observations_unique": 1307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 48.850
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 45.590
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}