Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "655db6fa418630f0254bd16e7d1f85aa",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.977,
"b": 67.823,
"c": 138.470,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.480,1.740],
"number_observations": 450830,
"number_observations_unique": 66547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "R(meas)",
"value": 0.193
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 7.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [1.770,1.740],
"number_observations": 21638,
"number_observations_unique": 3462,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.400
},
{
"type": "R(meas)",
"value": 3.711
},
{
"type": "R(pim)",
"value": 1.477
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.289
}
]
},
{
"resolution_limits": [138.480,9.030],
"number_observations": 3195,
"number_observations_unique": 577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 47.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.914
}
]
}
]
}