Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4eca21ecdd9a527ae854b2438725ff7d",
"space_group_name": "I 21 3",
"unit_cell": {
"a": 177.7,
"b": 177.7,
"c": 177.7,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91977],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.300,2.600],
"number_observations": 284021,
"number_observations_unique": 28796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.720,2.600],
"number_observations": 35787,
"number_observations_unique": 3478,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.422
},
{
"type": "R(meas)",
"value": 1.496
},
{
"type": "R(pim)",
"value": 0.465
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.546
}
]
},
{
"resolution_limits": [51.300,9.010],
"number_observations": 7320,
"number_observations_unique": 742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 31.500
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}