Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6a62732699ca25366b9f0cc5505389f6",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 82.497,
"b": 97.451,
"c": 58.280,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.140,2.290],
"number_observations": 67155,
"number_observations_unique": 10653,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "R(meas)",
"value": 0.223
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 9.300
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.370,2.290],
"number_observations": 4186,
"number_observations_unique": 889,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.099
},
{
"type": "R(meas)",
"value": 1.233
},
{
"type": "R(pim)",
"value": 0.543
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 85.700
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.607
}
]
},
{
"resolution_limits": [29.140,8.880],
"number_observations": 1338,
"number_observations_unique": 217,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 27.500
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}