Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2c4e4d20cdb0e8075fc0b1c98cf32e8f",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 27.143,
"b": 45.105,
"c": 89.278,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.28357],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.730,1.830],
"number_observations": 85169,
"number_observations_unique": 9789,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 51.600
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 8.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.870,1.830],
"number_observations": 1221,
"number_observations_unique": 484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 12.400
},
{
"type": "Completeness",
"value": 80.200
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [31.730,8.970],
"number_observations": 865,
"number_observations_unique": 93,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 78.200
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}