Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "439b4d4ebd3da527b0d8af52b2f3163e",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 103.129,
"b": 103.129,
"c": 254.438,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.790,2.280],
"number_observations_unique": 37392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 17.070
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.523
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.280],
"number_observations_unique": 5847,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.982
},
{
"type": "R(meas)",
"value": 1.040
},
{
"type": "I/SigI",
"value": 2.090
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 9.182
},
{
"type": "CC(1/2)",
"value": 0.670
}
]
},
{
"resolution_limits": [2.580,2.420],
"number_observations_unique": 5594,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.681
},
{
"type": "R(meas)",
"value": 0.713
},
{
"type": "I/SigI",
"value": 3.620
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.274
},
{
"type": "CC(1/2)",
"value": 0.878
}
]
},
{
"resolution_limits": [2.790,2.580],
"number_observations_unique": 5192,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.441
},
{
"type": "R(meas)",
"value": 0.462
},
{
"type": "I/SigI",
"value": 5.460
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.731
},
{
"type": "CC(1/2)",
"value": 0.942
}
]
},
{
"resolution_limits": [3.050,2.790],
"number_observations_unique": 4813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "R(meas)",
"value": 0.263
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.160
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
{
"resolution_limits": [3.410,3.050],
"number_observations_unique": 4390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 16.270
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.667
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [3.940,3.410],
"number_observations_unique": 3903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 10.916
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.820,3.940],
"number_observations_unique": 3358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.518
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.780,4.820],
"number_observations_unique": 2669,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.345
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [47.790,6.780],
"number_observations_unique": 1625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 9.193
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}