Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "eafb095710d3a1042487de3f59476bc9",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.409,
"b": 95.409,
"c": 45.626,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.160,1.270],
"number_observations": 570366,
"number_observations_unique": 53625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 17.200
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.290,1.270],
"number_observations": 7018,
"number_observations_unique": 2374,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.073
},
{
"type": "R(meas)",
"value": 1.311
},
{
"type": "R(pim)",
"value": 0.720
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 86.900
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.309
}
]
},
{
"resolution_limits": [41.160,6.840],
"number_observations": 4730,
"number_observations_unique": 380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 97.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.400
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
}
]
}