Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b6c2fdcc767fae82d2ed6f022f78447",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 117.338,
"b": 64.655,
"c": 74.600,
"alpha": 90.00,
"beta": 126.02,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.710,1.890],
"number_observations": 147365,
"number_observations_unique": 35752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 14.700
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.930,1.890],
"number_observations": 7604,
"number_observations_unique": 1891,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.664
},
{
"type": "R(meas)",
"value": 0.765
},
{
"type": "R(pim)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 82.300
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.736
}
]
},
{
"resolution_limits": [34.710,9.070],
"number_observations": 1240,
"number_observations_unique": 344,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(meas)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 44.100
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}