Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "438f0f913078272a6e574ed41df216fd",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 128.793,
"b": 128.793,
"c": 240.652,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.15330],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.820,2.100],
"number_observations_unique": 68728,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "R(meas)",
"value": 0.223
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.150,2.100],
"number_observations": 22383,
"number_observations_unique": 4199,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.136
},
{
"type": "R(meas)",
"value": 1.254
},
{
"type": "R(pim)",
"value": 0.515
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.568
}
]
},
{
"resolution_limits": [39.760,9.840],
"number_observations": 25394,
"number_observations_unique": 810,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 25.400
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 31.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}