Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5ecfc6080df3511da7940b51f3720073",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 108.243,
"b": 143.853,
"c": 164.272,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [14.942,2.300],
"number_observations_unique": 109615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.215
},
{
"type": "I/SigI",
"value": 7.880
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.512
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.440,2.300],
"number_observations_unique": 17352,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.234
},
{
"type": "R(meas)",
"value": 2.482
},
{
"type": "I/SigI",
"value": 0.740
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.274
},
{
"type": "CC(1/2)",
"value": 0.498
}
]
},
{
"resolution_limits": [2.600,2.440],
"number_observations_unique": 16346,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.547
},
{
"type": "R(meas)",
"value": 1.712
},
{
"type": "I/SigI",
"value": 1.140
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.457
},
{
"type": "CC(1/2)",
"value": 0.643
}
]
},
{
"resolution_limits": [2.800,2.600],
"number_observations_unique": 15279,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.096
},
{
"type": "R(meas)",
"value": 1.206
},
{
"type": "I/SigI",
"value": 1.710
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.709
},
{
"type": "CC(1/2)",
"value": 0.803
}
]
},
{
"resolution_limits": [3.060,2.800],
"number_observations_unique": 14153,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.605
},
{
"type": "R(meas)",
"value": 0.667
},
{
"type": "I/SigI",
"value": 3.030
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.620
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
},
{
"resolution_limits": [3.400,3.060],
"number_observations_unique": 12786,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.299
},
{
"type": "R(meas)",
"value": 0.331
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.335
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
{
"resolution_limits": [3.890,3.400],
"number_observations_unique": 11363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "I/SigI",
"value": 11.720
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.508
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
{
"resolution_limits": [4.690,3.890],
"number_observations_unique": 9731,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 20.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.792
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [6.330,4.690],
"number_observations_unique": 7701,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 21.280
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.468
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [14.942,6.330],
"number_observations_unique": 4904,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 39.160
},
{
"type": "Completeness",
"value": 92.400
},
{
"type": "Redundancy",
"value": 5.596
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}