Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "536deb1fef707b76035f0676ccde8069",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 98.698,
"b": 98.698,
"c": 382.605,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.350,1.920],
"number_observations": 937591,
"number_observations_unique": 84808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.209
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.960,1.920],
"number_observations": 43701,
"number_observations_unique": 4240,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.255
},
{
"type": "R(meas)",
"value": 4.474
},
{
"type": "R(pim)",
"value": 1.358
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
},
{
"resolution_limits": [49.350,10.180],
"number_observations": 6833,
"number_observations_unique": 717,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 34.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 9.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}