Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7c773131f5e0cd41c5b37901f57090a8",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 89.83,
"b": 133.05,
"c": 165.53,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.920,2.520],
"number_observations": 912466,
"number_observations_unique": 67767,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.255
},
{
"type": "R(meas)",
"value": 0.265
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 8.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.590,2.520],
"number_observations": 69285,
"number_observations_unique": 4980,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.772
},
{
"type": "R(meas)",
"value": 1.840
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.900
},
{
"type": "CC(1/2)",
"value": 0.610
}
]
},
{
"resolution_limits": [44.920,11.270],
"number_observations": 9545,
"number_observations_unique": 857,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 20.900
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}