Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f752e397baed4a099134ba30bb10ba11",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 90.89,
"b": 96.79,
"c": 76.33,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.257,2.33],
"number_observations_unique": 8574,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [3.050,2.890],
"number_observations": 4397,
"number_observations_unique": 1027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.397
},
{
"type": "R(meas)",
"value": 0.447
},
{
"type": "R(pim)",
"value": 0.199
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 93.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.931
}
]
},
{
"resolution_limits": [48.390,9.140],
"number_observations": 1028,
"number_observations_unique": 242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 16.100
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}