Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "71710a0fd1b63a0ea1ab72ac860b0021",
"space_group_name": "P 64 2 2",
"unit_cell": {
"a": 67.41,
"b": 67.41,
"c": 236.56,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.790,2.170],
"number_observations": 638608,
"number_observations_unique": 17808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 26.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 35.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.230,2.170],
"number_observations": 38718,
"number_observations_unique": 1269,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.576
},
{
"type": "R(meas)",
"value": 1.603
},
{
"type": "R(pim)",
"value": 0.287
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 30.500
},
{
"type": "CC(1/2)",
"value": 0.894
}
]
},
{
"resolution_limits": [33.790,9.710],
"number_observations": 6685,
"number_observations_unique": 265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 53.900
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 25.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}