Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2912e53b416ae33abd6f2feb083cf4e",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.829,
"b": 88.829,
"c": 39.575,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.410,0.980],
"number_observations": 1080783,
"number_observations_unique": 175068,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 16.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 26616,
"number_observations_unique": 7675,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.297
},
{
"type": "R(meas)",
"value": 1.519
},
{
"type": "R(pim)",
"value": 0.769
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 88.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.445
}
]
},
{
"resolution_limits": [44.410,5.370],
"number_observations": 8052,
"number_observations_unique": 1166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 60.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}