Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "2ee37e4ae97e91979301e4ef6ecb09f7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 48.97,
"b": 75.57,
"c": 99.25,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.92,1.57],
"number_observations_unique": 51903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "R(meas)",
"value": 0.232
},
{
"type": "I/SigI",
"value": 9.67
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 14.55
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [43.92,7.02],
"number_observations_unique": 631,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 30.5
},
{
"type": "Completeness",
"value": 94.3
},
{
"type": "Redundancy",
"value": 13.09
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.61,1.57],
"number_observations_unique": 3663,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.324
},
{
"type": "I/SigI",
"value": 1.88
},
{
"type": "Completeness",
"value": 96.5
},
{
"type": "Redundancy",
"value": 13.47
},
{
"type": "CC(1/2)",
"value": 0.63
}
]
}
]
}