Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c51a972cbb52f355bfcac01d163e046b",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.697,
"b": 88.697,
"c": 39.529,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.670,1.050],
"number_observations": 915333,
"number_observations_unique": 142315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 14.440
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.432
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.120,1.050],
"number_observations": 142633,
"number_observations_unique": 22704,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.409
},
{
"type": "R(meas)",
"value": 0.446
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.282
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
{
"resolution_limits": [1.190,1.120],
"number_observations": 138629,
"number_observations_unique": 21551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.243
},
{
"type": "R(meas)",
"value": 0.265
},
{
"type": "I/SigI",
"value": 4.710
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.433
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [1.290,1.190],
"number_observations": 130622,
"number_observations_unique": 20140,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "R(meas)",
"value": 0.176
},
{
"type": "I/SigI",
"value": 7.260
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.486
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [1.410,1.290],
"number_observations": 122135,
"number_observations_unique": 18506,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "I/SigI",
"value": 10.540
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
{
"resolution_limits": [1.580,1.410],
"number_observations": 110605,
"number_observations_unique": 16770,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 16.140
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.595
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [1.820,1.580],
"number_observations": 96862,
"number_observations_unique": 14810,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 23.630
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.540
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.230,1.820],
"number_observations": 77502,
"number_observations_unique": 12549,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 30.380
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.176
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.150,2.230],
"number_observations": 61633,
"number_observations_unique": 9777,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 35.060
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.304
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [39.670,3.150],
"number_observations": 34712,
"number_observations_unique": 5508,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 37.050
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.302
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}