Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "60138110be802b4d5e1a0bbe1d2c9b2a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 61.840,
"b": 81.067,
"c": 105.247,
"alpha": 90.00,
"beta": 93.64,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.100,2.010],
"number_observations": 266008,
"number_observations_unique": 68997,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.010],
"number_observations": 15685,
"number_observations_unique": 4157,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.433
},
{
"type": "R(meas)",
"value": 1.665
},
{
"type": "R(pim)",
"value": 0.837
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 93.100
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.387
}
]
},
{
"resolution_limits": [49.100,9.630],
"number_observations": 2455,
"number_observations_unique": 662,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 31.300
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}