Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f93cbbc9b238fedc7c0cb6f7443a3fac",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 33.23,
"b": 129.49,
"c": 138.73,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920,0.97934,0.91837],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.351,1.99],
"number_observations_unique": 41702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 10.180
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.61
}
]
},
"refln_shells": [
{
"resolution_limits": [2.06,1.99],
"number_observations": 14883,
"number_observations_unique": 4075,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.531
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.10
}
]
},
{
"resolution_limits": [2.14,2.06],
"number_observations": 14594,
"number_observations_unique": 3949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.408
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 98.40
}
]
},
{
"resolution_limits": [2.24,2.14],
"number_observations": 15552,
"number_observations_unique": 4233,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.314
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 98.10
}
]
},
{
"resolution_limits": [2.36,2.24],
"number_observations": 15401,
"number_observations_unique": 4209,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.248
},
{
"type": "I/SigI",
"value": 4.8
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [2.51,2.36],
"number_observations": 15358,
"number_observations_unique": 4180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [2.70,2.51],
"number_observations": 14852,
"number_observations_unique": 4067,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.155
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 98.90
}
]
},
{
"resolution_limits": [2.97,2.70],
"number_observations": 15139,
"number_observations_unique": 4180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [3.40,2.97],
"number_observations": 15083,
"number_observations_unique": 4194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 15.0
},
{
"type": "Completeness",
"value": 98.50
}
]
},
{
"resolution_limits": [4.27,3.40],
"number_observations": 14856,
"number_observations_unique": 4184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 22.2
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [47.351,4.27],
"number_observations": 15011,
"number_observations_unique": 4423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 25.6
},
{
"type": "Completeness",
"value": 96.00
}
]
}
]
}