Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bee35356702356a3837aeae17d3c8906",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 119.390,
"b": 119.390,
"c": 551.858,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [96.790,2.990],
"number_observations": 770154,
"number_observations_unique": 48607,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.326
},
{
"type": "R(meas)",
"value": 0.336
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.800
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [3.090,2.990],
"number_observations": 50223,
"number_observations_unique": 4315,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.759
},
{
"type": "R(meas)",
"value": 2.888
},
{
"type": "R(pim)",
"value": 0.832
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.224
}
]
},
{
"resolution_limits": [96.790,11.960],
"number_observations": 11338,
"number_observations_unique": 953,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 26.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}