Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8d5bff016b3e0a79e0cc284219aeeb1d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.850,
"b": 101.879,
"c": 146.029,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.100,2.370],
"number_observations": 179741,
"number_observations_unique": 27141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.370],
"number_observations": 19268,
"number_observations_unique": 2827,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.859
},
{
"type": "R(meas)",
"value": 3.091
},
{
"type": "R(pim)",
"value": 1.162
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.199
}
]
},
{
"resolution_limits": [48.100,8.870],
"number_observations": 3513,
"number_observations_unique": 608,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 34.900
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}