Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "493b7d2825712a18ecc807bfb11c14d4",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.620,
"b": 88.620,
"c": 39.353,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.310,0.990],
"number_observations": 1065005,
"number_observations_unique": 169125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 32714,
"number_observations_unique": 7683,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.254
},
{
"type": "R(meas)",
"value": 1.427
},
{
"type": "R(pim)",
"value": 0.666
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.593
}
]
},
{
"resolution_limits": [44.310,5.420],
"number_observations": 7733,
"number_observations_unique": 1128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 31.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}