Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "266fa491ecabae73ba227a01ac7832bc",
"space_group_name": "P 1",
"unit_cell": {
"a": 64.318,
"b": 67.117,
"c": 67.238,
"alpha": 79.84,
"beta": 76.21,
"gamma": 89.63
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.220,2.300],
"number_observations": 113743,
"number_observations_unique": 46585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations": 10523,
"number_observations_unique": 4228,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.454
},
{
"type": "R(meas)",
"value": 1.844
},
{
"type": "R(pim)",
"value": 1.117
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.341
}
]
},
{
"resolution_limits": [46.220,8.890],
"number_observations": 2077,
"number_observations_unique": 814,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 18.700
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}