Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "320caa9e94f7db21428ec47127549b3a",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 59.225,
"b": 59.225,
"c": 159.766,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91162,0.97951,0.97936],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.117,1.91],
"number_observations_unique": 25856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 19.170
},
{
"type": "Completeness",
"value": 99.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.91],
"number_observations": 18856,
"number_observations_unique": 4918,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.640
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.10
}
]
},
{
"resolution_limits": [2.06,1.98],
"number_observations": 20319,
"number_observations_unique": 4794,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.478
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [2.15,2.06],
"number_observations": 24358,
"number_observations_unique": 4646,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.414
},
{
"type": "I/SigI",
"value": 4.8
},
{
"type": "Completeness",
"value": 99.40
}
]
},
{
"resolution_limits": [2.26,2.15],
"number_observations": 27177,
"number_observations_unique": 4711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.278
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 99.10
}
]
},
{
"resolution_limits": [2.41,2.26],
"number_observations": 34318,
"number_observations_unique": 5103,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [2.59,2.41],
"number_observations": 36023,
"number_observations_unique": 4675,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 14.7
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [2.85,2.59],
"number_observations": 37443,
"number_observations_unique": 4856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 20.5
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [3.26,2.85],
"number_observations": 37178,
"number_observations_unique": 4838,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 30.8
},
{
"type": "Completeness",
"value": 99.60
}
]
},
{
"resolution_limits": [4.10,3.26],
"number_observations": 36819,
"number_observations_unique": 4832,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 44.6
},
{
"type": "Completeness",
"value": 99.60
}
]
},
{
"resolution_limits": [29.117,4.10],
"number_observations": 36869,
"number_observations_unique": 4919,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 52.0
},
{
"type": "Completeness",
"value": 99.10
}
]
}
]
}