Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2262d62d5029b395fafab237cbfa79ad",
"space_group_name": "H 3",
"unit_cell": {
"a": 178.001,
"b": 178.001,
"c": 115.127,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98002],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.380,2.350],
"number_observations_unique": 55906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.350],
"number_observations": 10723,
"number_observations_unique": 4366,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.033
},
{
"type": "R(meas)",
"value": 1.301
},
{
"type": "R(pim)",
"value": 0.779
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.649
}
]
},
{
"resolution_limits": [38.380,9.970],
"number_observations": 2048,
"number_observations_unique": 716,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 9.800
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
}
]
}