Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6afd86e90f9f24d4fabffdfec78a4f2d",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.777,
"b": 88.777,
"c": 39.559,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88563],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.390,1.000],
"number_observations": 1043430,
"number_observations_unique": 165648,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 36116,
"number_observations_unique": 7609,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.322
},
{
"type": "R(meas)",
"value": 1.482
},
{
"type": "R(pim)",
"value": 0.656
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 92.700
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.542
}
]
},
{
"resolution_limits": [44.390,5.480],
"number_observations": 7498,
"number_observations_unique": 1095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 33.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}