Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a734f4dc424e22811c2360a71939fadd",
"space_group_name": "P 1",
"unit_cell": {
"a": 34.981,
"b": 46.779,
"c": 46.809,
"alpha": 119.97,
"beta": 90.01,
"gamma": 90.02
},
"wavelengths": [0.92003],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.550,1.490],
"number_observations": 141306,
"number_observations_unique": 40395,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 35.400
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.520,1.490],
"number_observations": 7234,
"number_observations_unique": 1996,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 30.400
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [40.550,8.160],
"number_observations": 685,
"number_observations_unique": 224,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 35.500
},
{
"type": "Completeness",
"value": 87.200
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}