Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "33d7ada59976b4c6f885c2cc633d17e9",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 66.373,
"b": 66.373,
"c": 145.060,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.390,1.860],
"number_observations": 118106,
"number_observations_unique": 27947,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.900,1.860],
"number_observations_unique": 1591,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.882
},
{
"type": "R(meas)",
"value": 2.150
},
{
"type": "R(pim)",
"value": 1.023
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.304
}
]
},
{
"resolution_limits": [60.390,9.090],
"number_observations_unique": 280,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}