Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d5aec859aba974605d6032e135bd6f69",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 63.922,
"b": 64.676,
"c": 151.957,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97240],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.910,2.200],
"number_observations": 480765,
"number_observations_unique": 32763,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.170
},
{
"type": "R(meas)",
"value": 0.176
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 41665,
"number_observations_unique": 2791,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.426
},
{
"type": "R(meas)",
"value": 1.476
},
{
"type": "R(pim)",
"value": 0.378
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 14.900
},
{
"type": "CC(1/2)",
"value": 0.770
}
]
},
{
"resolution_limits": [48.910,9.070],
"number_observations": 6900,
"number_observations_unique": 548,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 41.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}