Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5cfddb57b4830c6aea2e1dd4a124fa77",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.708,
"b": 88.708,
"c": 39.461,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88551],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,0.980],
"number_observations": 1085675,
"number_observations_unique": 175294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 28615,
"number_observations_unique": 8161,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.463
},
{
"type": "R(meas)",
"value": 1.716
},
{
"type": "R(pim)",
"value": 0.867
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.407
}
]
},
{
"resolution_limits": [44.350,5.370],
"number_observations": 8090,
"number_observations_unique": 1164,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 70.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}