Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aa49ccab7c59d74963257fa2721f6221",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 78.305,
"b": 78.305,
"c": 38.025,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.030,1.300],
"number_observations": 773432,
"number_observations_unique": 29702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.187
},
{
"type": "R(meas)",
"value": 0.190
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.300],
"number_observations": 36506,
"number_observations_unique": 1417,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.740
},
{
"type": "R(meas)",
"value": 5.854
},
{
"type": "R(pim)",
"value": 1.137
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.800
},
{
"type": "CC(1/2)",
"value": 0.381
}
]
},
{
"resolution_limits": [38.030,7.120],
"number_observations": 4679,
"number_observations_unique": 236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 22.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}