Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "95bddb756d154717c911a370cd2d433f",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 147.99,
"b": 151.81,
"c": 67.53,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.330,3.500],
"number_observations": 369455,
"number_observations_unique": 19877,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.546
},
{
"type": "R(meas)",
"value": 0.562
},
{
"type": "R(pim)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 18.600
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [3.830,3.500],
"number_observations": 90791,
"number_observations_unique": 4647,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.290
},
{
"type": "R(meas)",
"value": 3.377
},
{
"type": "R(pim)",
"value": 0.758
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.614
}
]
},
{
"resolution_limits": [49.330,8.570],
"number_observations": 24984,
"number_observations_unique": 1484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 34.700
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 16.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}