Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9777e42f0030304661e757eaaeeca92",
"space_group_name": "P 1",
"unit_cell": {
"a": 35.027,
"b": 49.468,
"c": 85.274,
"alpha": 79.66,
"beta": 82.78,
"gamma": 77.07
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.620,1.890],
"number_observations": 74024,
"number_observations_unique": 38316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 8.800
},
{
"type": "Completeness",
"value": 88.100
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.890],
"number_observations": 4551,
"number_observations_unique": 2416,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.368
},
{
"type": "R(meas)",
"value": 0.521
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 84.700
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.639
}
]
},
{
"resolution_limits": [47.620,9.080],
"number_observations": 723,
"number_observations_unique": 379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}