Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3e1295557337070d979690d41ed5f609",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 47.780,
"b": 49.715,
"c": 114.248,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.89290],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [114.25,2.20],
"number_observations_unique": 14476,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 25.0
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 43.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [114.25,9.07],
"number_observations_unique": 263,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 48.9
},
{
"type": "Redundancy",
"value": 34.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.27,2.20],
"number_observations_unique": 1257,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.611
},
{
"type": "R(meas)",
"value": 0.629
},
{
"type": "R(pim)",
"value": 0.148
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Redundancy",
"value": 33.7
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}