Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dda6759aa672c84560b252bf68d3e64b",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 68.261,
"b": 68.261,
"c": 990.380,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.510,3.000],
"number_observations": 237557,
"number_observations_unique": 29791,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "R(meas)",
"value": 0.189
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [3.180,3.000],
"number_observations": 19190,
"number_observations_unique": 4493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.315
},
{
"type": "R(meas)",
"value": 0.356
},
{
"type": "R(pim)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.774
}
]
},
{
"resolution_limits": [49.510,9.000],
"number_observations": 21760,
"number_observations_unique": 1422,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 14.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 15.300
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}