Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "027fbd4f7046fe4a04647e257783faf1",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.579,
"b": 42.579,
"c": 217.086,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [108.540,2.150],
"number_observations": 294334,
"number_observations_unique": 11795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.420
},
{
"type": "R(meas)",
"value": 0.429
},
{
"type": "R(pim)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.000
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.150],
"number_observations": 43217,
"number_observations_unique": 1650,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.196
},
{
"type": "R(meas)",
"value": 5.298
},
{
"type": "R(pim)",
"value": 1.025
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.200
},
{
"type": "CC(1/2)",
"value": 0.810
}
]
},
{
"resolution_limits": [108.540,6.800],
"number_observations": 8867,
"number_observations_unique": 482,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 21.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 18.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}