Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0ad92eaf1c4b11b4bde8a8f5a85fbcd4",
"space_group_name": "P 65",
"unit_cell": {
"a": 40.446,
"b": 40.446,
"c": 117.266,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.71260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.090,1.050],
"number_observations": 1785472,
"number_observations_unique": 49784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 35.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.070,1.050],
"number_observations": 26043,
"number_observations_unique": 2032,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.001
},
{
"type": "R(meas)",
"value": 1.042
},
{
"type": "R(pim)",
"value": 0.281
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 80.600
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.855
}
]
}
]
}