Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "78c2d7e336377512c424112b9896768c",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.856,
"b": 88.856,
"c": 39.491,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88551],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.430,1.000],
"number_observations": 1044042,
"number_observations_unique": 165625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 13.600
},
{
"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": 35269,
"number_observations_unique": 7545,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.520
},
{
"type": "R(meas)",
"value": 1.710
},
{
"type": "R(pim)",
"value": 0.767
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 92.100
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.471
}
]
},
{
"resolution_limits": [44.430,5.480],
"number_observations": 7531,
"number_observations_unique": 1094,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 49.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}