Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7f8356bad48f409e27bde62678b0e572",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 60.289,
"b": 60.289,
"c": 96.328,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.160,1.030],
"number_observations": 1733212,
"number_observations_unique": 99343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 21.500
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 17.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.050,1.030],
"number_observations": 33145,
"number_observations_unique": 4185,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.634
},
{
"type": "R(meas)",
"value": 2.817
},
{
"type": "R(pim)",
"value": 0.974
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 86.700
},
{
"type": "Redundancy",
"value": 7.900
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
},
{
"resolution_limits": [48.160,5.640],
"number_observations": 13315,
"number_observations_unique": 721,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 74.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 18.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}